210 significant shell pairs computed in 0.000096 seconds
0
Computed Electron repulsion integrals Integrals in parallel in 3.316887 seconds

 ******************************************************************************************
 *            QuAcK                       QuAcK                         QuAcK             *
 *   __        __        __       __        __        __       __        __        __     *
 * <(o )___  <(o )___  <(o )___ <(o )___  <(o )___  <(o )___ <(o )___  <(o )___  <(o )___ *
 * ( ._> /   ( ._> /   ( ._> /  ( ._> /   ( ._> /   ( ._> /  ( ._> /   ( ._> /   ( ._> /  *
 *|--------------------------------------------------------------------------------------|*
 ******************************************************************************************

      ----------------------
             Number of atoms                2
      ----------------------

      ----------------------
Number of spin-up   electron                2
Number of spin-down electron                0
    Total number of electron                2
      ----------------------

      ----------------------
Number of core      electron                0
Number of Rydberg   electron                0
      ----------------------

          ------------------
          Molecular geometry
          ------------------
                    Atom n.                 1
                        Z =      1.0000000000
           Atom coordinates:     0.0000000000    0.0000000000    0.0000000000
                    Atom n.                 2
                        Z =      1.0000000000
           Atom coordinates:     0.0000000000    0.0000000000    2.4566439631

          ------------------
 Nuclear repulsion energy =      0.4070593928
          ------------------

          Gaussian basis set
          ------------------
                    Atom n.                 1
           number of shells                10
          ------------------
      s-type shell with K =                 6
                                    Exponents     Contraction
                                82.6400000000    0.0020060000
                                12.4100000000    0.0153430000
                                 2.8240000000    0.0755790000
                                 0.7977000000    0.2568750000
                                 0.2581000000    0.4973680000
                                 0.0898900000    0.2961330000
      s-type shell with K =                 1
                                    Exponents     Contraction
                                 0.7977000000    1.0000000000
      s-type shell with K =                 1
                                    Exponents     Contraction
                                 0.2581000000    1.0000000000
      s-type shell with K =                 1
                                    Exponents     Contraction
                                 0.0898900000    1.0000000000
      p-type shell with K =                 1
                                    Exponents     Contraction
                                 2.2920000000    1.0000000000
      p-type shell with K =                 1
                                    Exponents     Contraction
                                 0.8380000000    1.0000000000
      p-type shell with K =                 1
                                    Exponents     Contraction
                                 0.2920000000    1.0000000000
      d-type shell with K =                 1
                                    Exponents     Contraction
                                 2.0620000000    1.0000000000
      d-type shell with K =                 1
                                    Exponents     Contraction
                                 0.6620000000    1.0000000000
      f-type shell with K =                 1
                                    Exponents     Contraction
                                 1.3970000000    1.0000000000
          ------------------
                    Atom n.                 2
           number of shells                10
          ------------------
      s-type shell with K =                 6
                                    Exponents     Contraction
                                82.6400000000    0.0020060000
                                12.4100000000    0.0153430000
                                 2.8240000000    0.0755790000
                                 0.7977000000    0.2568750000
                                 0.2581000000    0.4973680000
                                 0.0898900000    0.2961330000
      s-type shell with K =                 1
                                    Exponents     Contraction
                                 0.7977000000    1.0000000000
      s-type shell with K =                 1
                                    Exponents     Contraction
                                 0.2581000000    1.0000000000
      s-type shell with K =                 1
                                    Exponents     Contraction
                                 0.0898900000    1.0000000000
      p-type shell with K =                 1
                                    Exponents     Contraction
                                 2.2920000000    1.0000000000
      p-type shell with K =                 1
                                    Exponents     Contraction
                                 0.8380000000    1.0000000000
      p-type shell with K =                 1
                                    Exponents     Contraction
                                 0.2920000000    1.0000000000
      d-type shell with K =                 1
                                    Exponents     Contraction
                                 2.0620000000    1.0000000000
      d-type shell with K =                 1
                                    Exponents     Contraction
                                 0.6620000000    1.0000000000
      f-type shell with K =                 1
                                    Exponents     Contraction
                                 1.3970000000    1.0000000000
          ------------------
            Number of shells               20
          ------------------

          ------------------
   Number of basis functions               70
          ------------------

 Scaling integrals by    1.0000000000000000     

                          Total CPU time for reading integrals =      1.154 seconds


  Lowdin orthogonalization


 ************************************************
 *    Unrestricted Hartree-Fock calculation     *
 ************************************************


 ----------------------------------------------------------
 |   # |           E(UHF) |          Ex(UHF) |       Conv |
 ----------------------------------------------------------
 |   1 |    -0.9172246423 |    -0.7106448981 |   1.000000 |
 |   2 |    -0.9365545626 |    -0.6751199420 |   0.019503 |
 |   3 |    -0.9387565454 |    -0.6629065903 |   0.005606 |
 |   4 |    -0.9390754443 |    -0.6586466912 |   0.002658 |
 |   5 |    -0.9391328805 |    -0.6571304158 |   0.001352 |
 |   6 |    -0.9391449216 |    -0.6565795591 |   0.000682 |
 |   7 |    -0.9391476680 |    -0.6563756191 |   0.000341 |
 |   8 |    -0.9391483209 |    -0.6562988366 |   0.000171 |
 |   9 |    -0.9391484793 |    -0.6562695021 |   0.000085 |
 |  10 |    -0.9391485180 |    -0.6562581531 |   0.000042 |
 |  11 |    -0.9391485276 |    -0.6562537155 |   0.000021 |
 |  12 |    -0.9391485299 |    -0.6562519648 |   0.000011 |
 |  13 |    -0.9391485305 |    -0.6562512691 |   0.000005 |
 |  14 |    -0.9391485307 |    -0.6562509910 |   0.000003 |
 |  15 |    -0.9391485307 |    -0.6562508792 |   0.000001 |
 |  16 |    -0.9391485307 |    -0.6562508341 |   0.000001 |
 |  17 |    -0.9391485307 |    -0.6562508159 |   0.000000 |
 |  18 |    -0.9391485307 |    -0.6562508085 |   0.000000 |
 |  19 |    -0.9391485307 |    -0.6562508055 |   0.000000 |
 ----------------------------------------------------------

           -------------------------------------------------
                   Summary              
           -------------------------------------------------
                One-electron    energy:     -1.6746819256 au
                One-electron a  energy:     -1.6746819256 au
                One-electron b  energy:      0.0000000000 au
                Kinetic         energy:      1.1299282862 au
                Kinetic      a  energy:      1.1299282862 au
                Kinetic      b  energy:      0.0000000000 au
                Potential       energy:     -2.8046102118 au
                Potential    a  energy:     -2.8046102118 au
                Potential    b  energy:      0.0000000000 au
           -------------------------------------------------
                Two-electron    energy:      0.3284740020 au
                Two-electron aa energy:      0.3284740020 au
                Two-electron ab energy:      0.0000000000 au
                Two-electron bb energy:      0.0000000000 au
                Hartree         energy:      0.9847248075 au
                Hartree      aa energy:      0.9847248075 au
                Hartree      ab energy:      0.0000000000 au
                Hartree      bb energy:      0.0000000000 au
                Exchange        energy:     -0.6562508055 au
                Exchange     a  energy:     -0.6562508055 au
                Exchange     b  energy:      0.0000000000 au
           -------------------------------------------------
                Electronic      energy:     -1.3462079235 au
                Nuclear      repulsion:      0.4070593928 au
                UHF             energy:     -0.9391485307 au
           -------------------------------------------------
                   UHF HOMO a    energy:        -9.648139 eV
                   UHF LUMO a    energy:         5.685123 eV
                   UHF HOMOa-LUMOa  gap:        15.333261 eV
           -------------------------------------------------
                   UHF HOMO b    energy:         0.000000 eV
                   UHF LUMO b    energy:        -0.456277 eV
                   UHF HOMOb-LUMOb gap :         0.000000 eV
           -------------------------------------------------
                    S (exact)          :         3.000000
                    S                  :         3.000000
                   <S**2> (exact)      :         2.000000
                   <S**2>              :         2.000000
           -------------------------------------------------
                    Dipole moment (Debye)    
                            X         Y         Z      Tot.
                     0.000000 -0.000000  0.000000  0.000000
           -------------------------------------------------

         -----------------------------------------
               UHF spin-up   orbital coefficients 
         -----------------------------------------
                 1              2              3              4              5
      1     0.73532297    -0.75278788     0.09220239    -0.06448657    -0.00000020
      2    -0.00184875    -0.00610422     0.17285490     0.18143296     0.00000010
      3    -0.05454258    -0.04892055    -1.66706923    -1.81774942    -0.00000081
      4    -0.11224086    -0.26446487     1.14313154     2.57727545     0.00000091
      5    -0.00000002     0.00000009     0.00000002     0.00000015    -0.44307926
      6    -0.00000000     0.00000001     0.00000000     0.00000002    -0.07486560
      7    -0.00526372     0.00171755    -0.03620138     0.12221193     0.00000006
      8     0.00000006    -0.00000033    -0.00000006    -0.00000054     1.59027627
      9     0.00000001    -0.00000005    -0.00000001    -0.00000008     0.26870361
     10     0.03316937     0.01036666     0.11956919    -0.45531727    -0.00000022
     11    -0.00000009     0.00000024     0.00000003     0.00000031    -0.86545345
     12    -0.00000001     0.00000004     0.00000000     0.00000005    -0.14623274
     13    -0.00287525     0.01704736    -0.06477203     0.22260603     0.00000014
     14     0.00044040    -0.00054908     0.01610152     0.01350436     0.00000001
     15     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     16     0.00000000     0.00000000    -0.00000000     0.00000000    -0.00287246
     17     0.00044040    -0.00054908     0.01610152     0.01350436     0.00000001
     18     0.00000000     0.00000000     0.00000000     0.00000000    -0.00048535
     19     0.00120382     0.00010084     0.01394212     0.01284350     0.00000001
     20     0.00153731    -0.00244453     0.18603897     0.18009695     0.00000008
     21     0.00000000     0.00000000     0.00000000     0.00000000    -0.00000000
     22    -0.00000000     0.00000000     0.00000000     0.00000000     0.00676287
     23     0.00153731    -0.00244453     0.18603897     0.18009695     0.00000008
     24    -0.00000000     0.00000000     0.00000000     0.00000000     0.00114270
     25     0.00564438    -0.00121480     0.17669115     0.18383523     0.00000009
     26    -0.00000003     0.00000014     0.00000003     0.00000022    -0.64273629
     27    -0.00000000     0.00000001     0.00000000     0.00000001    -0.04856783
     28    -0.00459659    -0.00037101    -0.01898544     0.07926465     0.00000004
     29    -0.00000001     0.00000006     0.00000001     0.00000010    -0.28744041
     30     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     31    -0.00000001     0.00000006     0.00000001     0.00000010    -0.29282536
     32    -0.00000000     0.00000002     0.00000000     0.00000003    -0.10860098
     33    -0.00459659    -0.00037101    -0.01898544     0.07926465     0.00000004
     34    -0.00000000     0.00000001     0.00000000     0.00000002    -0.04947771
     35    -0.00949488    -0.00121411    -0.05438817     0.18496177     0.00000009
     36     0.73532297     0.75278788     0.09220239     0.06448657     0.00000020
     37    -0.00184875     0.00610422     0.17285490    -0.18143296    -0.00000010
     38    -0.05454258     0.04892055    -1.66706923     1.81774942     0.00000081
     39    -0.11224086     0.26446487     1.14313154    -2.57727545    -0.00000091
     40     0.00000002     0.00000009    -0.00000002     0.00000015    -0.44307926
     41     0.00000000     0.00000001    -0.00000000     0.00000002    -0.07486560
     42     0.00526372     0.00171755     0.03620138     0.12221193     0.00000006
     43    -0.00000006    -0.00000033     0.00000006    -0.00000054     1.59027627
     44    -0.00000001    -0.00000005     0.00000001    -0.00000008     0.26870361
     45    -0.03316937     0.01036666    -0.11956919    -0.45531727    -0.00000022
     46     0.00000009     0.00000024    -0.00000003     0.00000031    -0.86545345
     47     0.00000001     0.00000004    -0.00000000     0.00000005    -0.14623274
     48     0.00287525     0.01704736     0.06477203     0.22260603     0.00000014
     49     0.00044040     0.00054908     0.01610152    -0.01350436    -0.00000001
     50     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     51     0.00000000     0.00000000    -0.00000000    -0.00000000     0.00287246
     52     0.00044040     0.00054908     0.01610152    -0.01350436    -0.00000001
     53     0.00000000     0.00000000     0.00000000    -0.00000000     0.00048535
     54     0.00120382    -0.00010084     0.01394212    -0.01284350    -0.00000001
     55     0.00153731     0.00244453     0.18603897    -0.18009695    -0.00000008
     56     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     57    -0.00000000    -0.00000000     0.00000000    -0.00000000    -0.00676287
     58     0.00153731     0.00244453     0.18603897    -0.18009695    -0.00000008
     59    -0.00000000    -0.00000000     0.00000000    -0.00000000    -0.00114270
     60     0.00564438     0.00121480     0.17669115    -0.18383523    -0.00000009
     61     0.00000003     0.00000014    -0.00000003     0.00000022    -0.64273629
     62     0.00000000     0.00000001    -0.00000000     0.00000001    -0.04856783
     63     0.00459659    -0.00037101     0.01898544     0.07926465     0.00000004
     64     0.00000001     0.00000006    -0.00000001     0.00000010    -0.28744041
     65     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     66     0.00000001     0.00000006    -0.00000001     0.00000010    -0.29282536
     67     0.00000000     0.00000002    -0.00000000     0.00000003    -0.10860098
     68     0.00459659    -0.00037101     0.01898544     0.07926465     0.00000004
     69     0.00000000     0.00000001    -0.00000000     0.00000002    -0.04947771
     70     0.00949488    -0.00121411     0.05438817     0.18496177     0.00000009
                 6              7              8              9             10
      1     0.00000000    -0.11292207    -0.00000001    -0.00000001    -0.56700979
      2    -0.00000000    -0.04653207     0.00000001     0.00000002     0.10289106
      3     0.00000001     0.98703587    -0.00000012    -0.00000020    -1.59367696
      4    -0.00000002    -0.39157561     0.00000005     0.00000008    -1.15655647
      5     0.07486560    -0.00000008    -0.23103870    -0.54558064    -0.00000004
      6    -0.44307926    -0.00000001    -0.54558064     0.23103870    -0.00000001
      7    -0.00000000    -0.53115372     0.00000005     0.00000008    -0.68099655
      8    -0.26870361     0.00000029     0.83896987     1.98116470     0.00000014
      9     1.59027627     0.00000004     1.98116470    -0.83896987     0.00000002
     10     0.00000000     1.89497066    -0.00000017    -0.00000028     2.55588870
     11     0.14623274    -0.00000020    -0.55150479    -1.30233738    -0.00000004
     12    -0.86545345    -0.00000003    -1.30233738     0.55150479    -0.00000001
     13    -0.00000000    -1.10461643     0.00000009     0.00000015    -3.11796775
     14    -0.00000000    -0.00568943     0.00000000     0.00000000    -0.01635110
     15     0.00000000     0.00000000    -0.00000000     0.00000000     0.00000000
     16     0.00048535     0.00000000     0.00155667     0.00367597     0.00000000
     17     0.00000000    -0.00568943     0.00000000     0.00000000    -0.01635110
     18    -0.00287246     0.00000000     0.00367597    -0.00155667     0.00000000
     19     0.00000000    -0.01583492     0.00000000     0.00000000     0.02627114
     20    -0.00000000    -0.07042299     0.00000001     0.00000002     0.04109488
     21    -0.00000000     0.00000000     0.00000000    -0.00000000     0.00000000
     22    -0.00114270    -0.00000001    -0.00575620    -0.01359284     0.00000000
     23    -0.00000000    -0.07042299     0.00000001     0.00000002     0.04109488
     24     0.00676287    -0.00000000    -0.01359284     0.00575620     0.00000000
     25    -0.00000000    -0.08139054     0.00000001     0.00000002    -0.21327984
     26     0.10860098    -0.00000012    -0.33446187    -0.78980673    -0.00000006
     27    -0.28744041    -0.00000001    -0.35321231     0.14957589    -0.00000000
     28    -0.00000000    -0.33816650     0.00000003     0.00000005    -0.43352755
     29     0.04856783    -0.00000005    -0.14957589    -0.35321231    -0.00000003
     30     0.00000000     0.00000000     0.00000000    -0.00000000     0.00000000
     31     0.04947771    -0.00000005    -0.14894934    -0.35173274    -0.00000003
     32    -0.64273629    -0.00000002    -0.78980673     0.33446187    -0.00000001
     33    -0.00000000    -0.33816650     0.00000003     0.00000005    -0.43352755
     34    -0.29282536    -0.00000001    -0.35173274     0.14894934    -0.00000000
     35    -0.00000000    -0.76748003     0.00000007     0.00000011    -1.01142561
     36    -0.00000000    -0.11292207    -0.00000001    -0.00000001     0.56700979
     37     0.00000000    -0.04653207     0.00000001     0.00000002    -0.10289106
     38    -0.00000001     0.98703587    -0.00000012    -0.00000020     1.59367696
     39     0.00000002    -0.39157561     0.00000005     0.00000008     1.15655647
     40     0.07486560     0.00000008     0.23103870     0.54558064    -0.00000004
     41    -0.44307926     0.00000001     0.54558064    -0.23103870    -0.00000001
     42    -0.00000000     0.53115372    -0.00000005    -0.00000008    -0.68099655
     43    -0.26870361    -0.00000029    -0.83896987    -1.98116470     0.00000014
     44     1.59027627    -0.00000004    -1.98116470     0.83896987     0.00000002
     45     0.00000000    -1.89497066     0.00000017     0.00000028     2.55588870
     46     0.14623274     0.00000020     0.55150479     1.30233738    -0.00000004
     47    -0.86545345     0.00000003     1.30233738    -0.55150479    -0.00000001
     48    -0.00000000     1.10461643    -0.00000009    -0.00000015    -3.11796775
     49     0.00000000    -0.00568943     0.00000000     0.00000000     0.01635110
     50    -0.00000000     0.00000000    -0.00000000     0.00000000     0.00000000
     51    -0.00048535     0.00000000     0.00155667     0.00367597    -0.00000000
     52     0.00000000    -0.00568943     0.00000000     0.00000000     0.01635110
     53     0.00287246     0.00000000     0.00367597    -0.00155667     0.00000000
     54     0.00000000    -0.01583492     0.00000000     0.00000000    -0.02627114
     55     0.00000000    -0.07042299     0.00000001     0.00000002    -0.04109488
     56     0.00000000     0.00000000     0.00000000    -0.00000000     0.00000000
     57     0.00114270    -0.00000001    -0.00575620    -0.01359284    -0.00000000
     58     0.00000000    -0.07042299     0.00000001     0.00000002    -0.04109488
     59    -0.00676287    -0.00000000    -0.01359284     0.00575620    -0.00000000
     60     0.00000000    -0.08139054     0.00000001     0.00000002     0.21327984
     61     0.10860098     0.00000012     0.33446187     0.78980673    -0.00000006
     62    -0.28744041     0.00000001     0.35321231    -0.14957589    -0.00000000
     63    -0.00000000     0.33816650    -0.00000003    -0.00000005    -0.43352755
     64     0.04856783     0.00000005     0.14957589     0.35321231    -0.00000003
     65     0.00000000     0.00000000    -0.00000000     0.00000000     0.00000000
     66     0.04947771     0.00000005     0.14894934     0.35173274    -0.00000003
     67    -0.64273629     0.00000002     0.78980673    -0.33446187    -0.00000001
     68    -0.00000000     0.33816650    -0.00000003    -0.00000005    -0.43352755
     69    -0.29282536     0.00000001     0.35173274    -0.14894934    -0.00000000
     70    -0.00000000     0.76748003    -0.00000007    -0.00000011    -1.01142561
                11             12             13             14             15
      1     1.94148596     1.84215304    -0.00000000     0.00000004    -0.50152763
      2     0.97813760     1.30082825    -0.00000000     0.00000000    -0.15155795
      3    -4.50719631    -7.05234688     0.00000000    -0.00000003     1.06053142
      4     0.35812931     0.81128612    -0.00000000     0.00000002    -0.07558657
      5     0.00000002     0.00000002    -0.05066900    -1.39525105     0.00000003
      6     0.00000000     0.00000000     1.39525105    -0.05066900     0.00000000
      7    -0.21185799    -0.08263643    -0.00000000     0.00000002    -1.43180729
      8    -0.00000006    -0.00000007     0.19237238     5.29727777    -0.00000012
      9    -0.00000001    -0.00000001    -5.29727777     0.19237238    -0.00000002
     10     0.82051517     0.33541301     0.00000001    -0.00000008     5.44645381
     11     0.00000002     0.00000003    -0.03616884    -0.99596633     0.00000002
     12     0.00000000     0.00000000     0.99596633    -0.03616884     0.00000000
     13    -0.19289815    -1.64741762    -0.00000000     0.00000004    -1.23632367
     14     0.04293382     0.02623101     0.00000000     0.00000000    -0.00327168
     15     0.00000000     0.00000000    -0.00000000     0.00000000     0.00000000
     16     0.00000000    -0.00000000    -0.00110941    -0.03054944     0.00000000
     17     0.04293382     0.02623101    -0.00000000     0.00000000    -0.00327168
     18     0.00000000     0.00000000     0.03054944    -0.00110941     0.00000000
     19     0.03731315     0.05593887     0.00000000     0.00000000    -0.03205783
     20     0.68855461     0.82336140    -0.00000000     0.00000002    -0.11733422
     21     0.00000000     0.00000000    -0.00000001     0.00000000     0.00000000
     22    -0.00000000     0.00000000     0.00827996     0.22800182     0.00000001
     23     0.68855461     0.82336140    -0.00000000     0.00000002    -0.11733422
     24    -0.00000000     0.00000000    -0.22800182     0.00827996     0.00000000
     25     0.69381897     0.60512973    -0.00000000     0.00000001    -0.09957584
     26     0.00000003     0.00000003    -0.07474844    -2.05831638     0.00000005
     27     0.00000000     0.00000000     0.92050707    -0.03342852     0.00000000
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     43     0.00000006    -0.00000007     0.19237238     5.29727777     0.00000012
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                16             17             18             19             20
      1     0.00000000     0.00000000    -0.00000000    -0.00000001     0.00000000
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      6     0.00000001    -0.00000009     1.62700944    -0.35355670    -0.71084167
      7     0.00000000     0.00000000     0.00000001     0.00000003     0.00000001
      8     0.00000032     0.00000005    -1.35011722    -6.21301605    -0.17015904
      9    -0.00000005     0.00000032    -6.21301605     1.35011722     2.68542871
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     12     0.00000001    -0.00000007     1.44122991    -0.31318595    -0.37981545
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     21     0.00008868     0.71205497     0.00000003    -0.00000000     0.00000004
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     23    -0.61665770     0.00007680    -0.00000001    -0.00000005     0.00000001
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     27     0.00000001    -0.00000005     1.06878139    -0.23225116    -0.47520702
     28     0.00884423    -0.00000110     0.00000001     0.00000002     0.00000000
     29    -0.00000006    -0.00000001     0.23225116     1.06878139     0.03011094
     30     0.00000127     0.01021244     0.00000000    -0.00000000    -0.00000000
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     32     0.00000002    -0.00000013     2.38986785    -0.51932937    -1.06259520
     33    -0.00884423     0.00000110     0.00000001     0.00000002     0.00000000
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     42     0.00000000     0.00000000    -0.00000001    -0.00000003     0.00000001
     43    -0.00000032    -0.00000005     1.35011722     6.21301605    -0.17015904
     44     0.00000005    -0.00000032     6.21301605    -1.35011722     2.68542871
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     47    -0.00000001     0.00000007    -1.44122991     0.31318595    -0.37981545
     48     0.00000000     0.00000000    -0.00000001    -0.00000003     0.00000001
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     65    -0.00000127    -0.01021244    -0.00000000     0.00000000    -0.00000000
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     67    -0.00000002     0.00000013    -2.38986785     0.51932937    -1.06259520
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      1    -0.00000001     0.00000000     0.00000000    -0.11996636    -0.35381840
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      8    -2.68542871     0.00000013    -0.00000002     0.00000010     0.00000002
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     17    -0.00000000    -0.09112580     0.00023417    -0.03998972     0.04318001
     18    -0.00500155    -0.00000000    -0.00000000     0.00000000     0.00000000
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     20    -0.00000005    -0.71121046     0.00182762     0.08042423    -0.71737622
     21    -0.00000001     0.00211036     0.82123511     0.00000000     0.00000000
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     23     0.00000001     0.71121046    -0.00182762     0.08042423    -0.71737622
     24     0.03907685     0.00000000     0.00000003    -0.00000000    -0.00000001
     25    -0.00000000     0.00000000     0.00000000    -0.82669174     0.61255928
     26     1.06259520    -0.00000006     0.00000001    -0.00000004    -0.00000001
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     40     0.71084167    -0.00000003     0.00000001    -0.00000003     0.00000000
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     46     0.37981545    -0.00000002     0.00000000    -0.00000001     0.00000004
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     49    -0.00000000    -0.09112580     0.00023417     0.03998972     0.04318001
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     61     1.06259520    -0.00000006     0.00000001    -0.00000004     0.00000001
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                26             27             28             29             30
      1    -0.00000002     0.00000006    -1.14348432     0.96951926    -0.53915758
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      4    -0.00000000     0.00000001    -0.28431913     0.56704515    -0.24864997
      5    -0.01360461     0.10128836     0.00000000     0.00000000     0.00000003
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      8     0.04975263    -0.37041579     0.00000002    -0.00000004    -0.00000010
      9     0.37041579     0.04975263     0.00000000    -0.00000001    -0.00000001
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     11     0.06381599    -0.47511960    -0.00000003     0.00000001     0.00000001
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     21    -0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
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     23    -0.00000003     0.00000010    -1.34484810     1.62846173    -0.02583515
     24     1.14548239     0.15385619    -0.00000001     0.00000000     0.00000000
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     26    -0.01905251     0.14184879    -0.00000000     0.00000001     0.00000005
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     29    -0.00852054     0.06343671    -0.00000000     0.00000001     0.00000002
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     38     0.00000006    -0.00000021     4.07094181     6.36652537     0.67326529
     39    -0.00000000     0.00000001    -0.28431913    -0.56704515     0.24864997
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     43    -0.04975263     0.37041579    -0.00000002    -0.00000004    -0.00000010
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     55    -0.00000003     0.00000010    -1.34484810    -1.62846173     0.02583515
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     58    -0.00000003     0.00000010    -1.34484810    -1.62846173     0.02583515
     59     1.14548239     0.15385619    -0.00000001    -0.00000000    -0.00000000
     60    -0.00000000     0.00000001    -1.24995124    -0.34782282     3.03312919
     61     0.01905251    -0.14184879     0.00000000     0.00000001     0.00000005
     62     0.06343671     0.00852054     0.00000000     0.00000000     0.00000000
     63    -0.00000001     0.00000004     0.18737671     0.13536116     0.72150709
     64     0.00852054    -0.06343671     0.00000000     0.00000001     0.00000002
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     67     0.14184879     0.01905251     0.00000000     0.00000000     0.00000001
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                51             52             53             54             55
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     17    -0.74288914    -0.02253316    -0.75836226     0.00000005    -0.00000003
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     19     0.00000000     0.00000000     0.00000000    -0.00000000     0.00000000
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     27     0.00000001     0.00000003     0.00000000     0.00214645     0.00286944
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     29    -0.00000004     0.00000000    -0.00000002    -0.00286944     0.00214645
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     31    -0.00000001     0.00000000    -0.00000001     0.09527643    -0.07127015
     32     0.00000002     0.00000005     0.00000001     0.00479960     0.00641627
     33    -0.02477757     0.00268517     0.09037060    -0.00000004     0.00000003
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     47    -0.00000000     0.00000001     0.00000000     0.00307065     0.00410495
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     62    -0.00000001     0.00000003     0.00000000     0.00214645     0.00286944
     63    -0.02477757    -0.00268517    -0.09037060    -0.00000001     0.00000002
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     67    -0.00000002     0.00000005     0.00000001     0.00479960     0.00641627
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      1     0.00000002     0.00000004     0.35624637    -4.60853543     2.92296644
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      7     0.00000001     0.00000003     0.34135881    -0.43189596     3.99682151
      8     0.26325270     1.09486481    -0.00000008     0.00000008     0.00000011
      9     1.09486481    -0.26325270    -0.00000001     0.00000001     0.00000002
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     11     0.05670078     0.23581787     0.00000001    -0.00000000    -0.00000001
     12     0.23581787    -0.05670078     0.00000000    -0.00000000    -0.00000000
     13     0.00000000     0.00000001    -1.57475675     0.12282242    -0.52802383
     14    -0.00000000     0.00000000    -0.34792599     0.58005176    -0.21567669
     15     0.00000000    -0.00000000     0.00000000     0.00000000     0.00000000
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     17    -0.00000000    -0.00000000    -0.34792599     0.58005176    -0.21567669
     18    -0.83578359     0.20095841     0.00000000    -0.00000000    -0.00000000
     19     0.00000000     0.00000000     1.00650064    -0.67776972     0.19589027
     20     0.00000000     0.00000001     0.52415866    -0.72072005     0.39480199
     21    -0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     22     0.22098388     0.91906928     0.00000000     0.00000001     0.00000000
     23     0.00000000     0.00000001     0.52415866    -0.72072005     0.39480199
     24     0.91906928    -0.22098388     0.00000000     0.00000000     0.00000000
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     28     0.00000001     0.00000003    -0.02283841    -0.64124963     3.61592831
     29    -0.08441198    -0.35106839     0.00000002    -0.00000002    -0.00000003
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     31     0.07347893     0.30559799     0.00000002    -0.00000000    -0.00000003
     32    -0.78501280     0.18875092     0.00000001    -0.00000001    -0.00000001
     33     0.00000001     0.00000003    -0.02283841    -0.64124963     3.61592831
     34     0.30559799    -0.07347893     0.00000000    -0.00000000    -0.00000000
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     37    -0.00000000    -0.00000001     0.24762344     0.67942395     1.26590770
     38    -0.00000002    -0.00000004     2.20053990     3.41665915     3.05546411
     39    -0.00000000    -0.00000001     0.19578167     1.20668259     0.61799076
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     42    -0.00000001    -0.00000003     0.34135881     0.43189596     3.99682151
     43    -0.26325270    -1.09486481    -0.00000008    -0.00000008     0.00000011
     44    -1.09486481     0.26325270    -0.00000001    -0.00000001     0.00000002
     45     0.00000004     0.00000011    -0.36494087    -1.54859429   -15.93674427
     46    -0.05670078    -0.23581787     0.00000001     0.00000000    -0.00000001
     47    -0.23581787     0.05670078     0.00000000     0.00000000    -0.00000000
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     59     0.91906928    -0.22098388    -0.00000000     0.00000000    -0.00000000
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     67     0.78501280    -0.18875092     0.00000001     0.00000001    -0.00000001
     68    -0.00000001    -0.00000003    -0.02283841     0.64124963     3.61592831
     69    -0.30559799     0.07347893     0.00000000     0.00000000    -0.00000000
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                61             62             63             64             65
      1     0.00000007    -0.00000053    -2.16906265     9.03407976     0.00000042
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      7    -0.00000003     0.00000021     1.22467931    -2.01834982    -0.00000006
      8     1.77172450    -5.97861658     0.00000033    -0.00000039     4.67439023
      9    -5.97861658    -1.77172450     0.00000005    -0.00000006     5.00769454
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     13    -0.00000000     0.00000000     0.50960564     0.04360816    -0.00000001
     14    -0.00000001     0.00000003     0.14835714    -0.48902471    -0.00000001
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     16    -0.00444341     0.01499413     0.00000001     0.00000000     0.01651307
     17    -0.00000000     0.00000002     0.14835714    -0.48902471    -0.00000000
     18     0.01499413     0.00444341     0.00000000     0.00000000     0.01769052
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     20     0.00000001    -0.00000005    -0.10784768     0.62846009     0.00000002
     21    -0.00000000    -0.00000000     0.00000000     0.00000000     0.00000000
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     26    -1.00689724     3.39773623    -0.00000018     0.00000022    -2.56557579
     27     1.51951384     0.45029813    -0.00000001     0.00000001    -1.22917215
     28    -0.00000002     0.00000017     1.85024589    -1.58653318    -0.00000008
     29    -0.45029813     1.51951384    -0.00000008     0.00000010    -1.14736037
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     33    -0.00000002     0.00000017     1.85024589    -1.58653318    -0.00000008
     34     1.48250751     0.43933155    -0.00000001     0.00000001    -1.26587666
     35    -0.00000004     0.00000027     3.67414906    -2.43913146    -0.00000013
     36    -0.00000007     0.00000053    -2.16906265    -9.03407976     0.00000042
     37     0.00000001    -0.00000008     0.53206100     1.33607792    -0.00000012
     38     0.00000005    -0.00000037     1.24787219     6.16623186    -0.00000027
     39     0.00000002    -0.00000013     0.62706981     2.27504227    -0.00000011
     40    -0.26229011     0.88508795     0.00000005     0.00000006     0.74453133
     41     0.88508795     0.26229011     0.00000001     0.00000001     0.79761965
     42    -0.00000003     0.00000021    -1.22467931    -2.01834982     0.00000006
     43     1.77172450    -5.97861658    -0.00000033    -0.00000039    -4.67439023
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     46    -0.12166779     0.41056332     0.00000003     0.00000003     0.40688551
     47     0.41056332     0.12166779     0.00000000     0.00000000     0.43589822
     48    -0.00000000     0.00000000    -0.50960564     0.04360816     0.00000001
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     50    -0.00000000    -0.00000000     0.00000000     0.00000000    -0.00000000
     51     0.00444341    -0.01499413     0.00000001    -0.00000000     0.01651307
     52     0.00000000    -0.00000002     0.14835714     0.48902471    -0.00000000
     53    -0.01499413    -0.00444341     0.00000000    -0.00000000     0.01769052
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     62     1.51951384     0.45029813     0.00000001     0.00000001     1.22917215
     63    -0.00000002     0.00000017    -1.85024589    -1.58653318     0.00000008
     64    -0.45029813     1.51951384     0.00000008     0.00000010     1.14736037
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     67     3.39773623     1.00689724     0.00000003     0.00000003     2.74851248
     68    -0.00000002     0.00000017    -1.85024589    -1.58653318     0.00000008
     69     1.48250751     0.43933155     0.00000001     0.00000001     1.26587666
     70    -0.00000004     0.00000027    -3.67414906    -2.43913146     0.00000013
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      7     0.00000004    -0.14063741    -0.94905953     0.10979490     0.63594909
      8    -5.00769454    -0.00000029    -0.00000001     0.00000001     0.00000001
      9     4.67439023    -0.00000004    -0.00000000     0.00000000     0.00000000
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     11     0.43589822     0.00000003     0.00000000    -0.00000000    -0.00000000
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     13     0.00000001     0.18299935     1.20087901    -0.05423301     0.60884841
     14     0.00000001    -0.16862135     0.08840812    -3.52412304    -3.68173326
     15    -0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     16    -0.01769052    -0.00000000     0.00000001     0.00000000     0.00000000
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     23    -0.00000002     0.37240643     0.04390306    -3.26834750    -3.57066523
     24    -0.01110104     0.00000000    -0.00000000     0.00000000     0.00000000
     25    -0.00000003     0.87953843     2.18330812    -3.30719988    -3.65344715
     26     2.74851248     0.00000016     0.00000001    -0.00000001    -0.00000000
     27    -1.14736037     0.00000001     0.00000000    -0.00000000    -0.00000000
     28     0.00000006    -0.06926103    -0.16479350     0.15100449     0.46152162
     29     1.22917215     0.00000007     0.00000000    -0.00000000    -0.00000000
     30    -0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     31     1.26587666     0.00000008     0.00000000    -0.00000000    -0.00000000
     32    -2.56557579     0.00000002     0.00000000    -0.00000000    -0.00000000
     33     0.00000006    -0.06926103    -0.16479350     0.15100449     0.46152162
     34    -1.18162189     0.00000001     0.00000000    -0.00000000    -0.00000000
     35     0.00000010     0.43836319     1.61773139     0.02626771     1.35055181
     36    -0.00000033     9.04565939    -0.66967394   -54.51360824    57.45106626
     37     0.00000009    -2.24672681     0.24462633    26.55063782   -27.43544024
     38     0.00000021    -5.71096484    -0.13059349    31.89400907   -34.83738602
     39     0.00000009    -2.45075255    -0.08083324    15.44933419   -15.91540650
     40    -0.79761965    -0.00000005     0.00000000     0.00000000    -0.00000000
     41     0.74453133    -0.00000001     0.00000000     0.00000000    -0.00000000
     42    -0.00000004     0.14063741    -0.94905953    -0.10979490     0.63594909
     43     5.00769454     0.00000029    -0.00000001    -0.00000001     0.00000001
     44    -4.67439023     0.00000004    -0.00000000    -0.00000000     0.00000000
     45     0.00000021     0.42996497     0.88785092     0.19148398    -2.68721364
     46    -0.43589822    -0.00000003     0.00000000     0.00000000    -0.00000000
     47     0.40688551    -0.00000000     0.00000000     0.00000000     0.00000000
     48    -0.00000001    -0.18299935     1.20087901     0.05423301     0.60884841
     49     0.00000001    -0.16862135    -0.08840812    -3.52412304     3.68173326
     50    -0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     51    -0.01769052    -0.00000000    -0.00000001     0.00000000     0.00000000
     52     0.00000000    -0.16862135    -0.08840812    -3.52412304     3.68173326
     53     0.01651307    -0.00000000    -0.00000000     0.00000000     0.00000000
     54     0.00000002    -0.82124272    -0.29869456    -3.51744850     3.59653449
     55    -0.00000002     0.37240643    -0.04390306    -3.26834750     3.57066523
     56     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     57     0.01189260     0.00000000     0.00000000     0.00000000     0.00000000
     58    -0.00000002     0.37240643    -0.04390306    -3.26834750     3.57066523
     59    -0.01110104     0.00000000     0.00000000     0.00000000     0.00000000
     60    -0.00000003     0.87953843    -2.18330812    -3.30719988     3.65344715
     61    -2.74851248    -0.00000016     0.00000001     0.00000001    -0.00000000
     62     1.14736037    -0.00000001     0.00000000     0.00000000    -0.00000000
     63    -0.00000006     0.06926103    -0.16479350    -0.15100449     0.46152162
     64    -1.22917215    -0.00000007     0.00000000     0.00000000    -0.00000000
     65     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     66    -1.26587666    -0.00000008     0.00000000     0.00000000    -0.00000000
     67     2.56557579    -0.00000002     0.00000000     0.00000000    -0.00000000
     68    -0.00000006     0.06926103    -0.16479350    -0.15100449     0.46152162
     69     1.18162189    -0.00000001     0.00000000     0.00000000    -0.00000000
     70    -0.00000010    -0.43836319     1.61773139    -0.02626771     1.35055181

         -----------------------------------------
               UHF spin-down orbital coefficients 
         -----------------------------------------
                 1              2              3              4              5
      1     0.55870813     0.47258629     0.01999971    -0.19073999    -0.00000001
      2    -0.01190346     0.05551070     0.25272949     0.28263712     0.00000000
      3    -0.37681265    -0.75172424    -1.94151514    -2.12419672    -0.00000003
      4     0.30613586     1.65523564     1.13748974     2.12755458     0.00000004
      5     0.00000002     0.00000004     0.00000002    -0.00000048    -0.06573135
      6     0.00000000     0.00000001     0.00000000    -0.00000007     0.49523144
      7     0.00584621     0.05672410    -0.03019548     0.15490706     0.00000000
      8    -0.00000006    -0.00000014    -0.00000010     0.00000172     0.23873274
      9    -0.00000001    -0.00000002    -0.00000001     0.00000026    -1.79865412
     10    -0.01182868    -0.22104816     0.10040556    -0.57161033    -0.00000001
     11     0.00000007     0.00000009     0.00000002    -0.00000092    -0.12064895
     12     0.00000001     0.00000001     0.00000000    -0.00000014     0.90899027
     13     0.02652459     0.11830090    -0.04345077     0.30675952     0.00000001
     14     0.00457078     0.00731963     0.01748412     0.01389810     0.00000000
     15     0.00000000     0.00000000     0.00000000     0.00000000    -0.00000000
     16    -0.00000000     0.00000000    -0.00000000    -0.00000000    -0.00037922
     17     0.00457078     0.00731963     0.01748412     0.01389810    -0.00000000
     18     0.00000000     0.00000000     0.00000000    -0.00000000     0.00285708
     19     0.00474277     0.00627805     0.01529388     0.01264002     0.00000000
     20     0.03407334     0.07971805     0.22081940     0.21562919    -0.00000000
     21     0.00000000     0.00000000     0.00000000     0.00000000     0.00000002
     22     0.00000000    -0.00000001    -0.00000000     0.00000001     0.00100906
     23     0.03407334     0.07971805     0.22081940     0.21562919     0.00000001
     24     0.00000000    -0.00000000     0.00000000     0.00000000    -0.00760245
     25     0.03554485     0.08232501     0.21219112     0.22195827     0.00000000
     26     0.00000003     0.00000006     0.00000004    -0.00000069    -0.09567952
     27     0.00000000     0.00000000     0.00000000    -0.00000005     0.32238116
     28     0.00349300     0.03783234    -0.01451286     0.09957095     0.00000000
     29     0.00000001     0.00000003     0.00000002    -0.00000031    -0.04278918
     30     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     31     0.00000001     0.00000003     0.00000002    -0.00000032    -0.04352644
     32     0.00000000     0.00000001     0.00000001    -0.00000010     0.72086620
     33     0.00349300     0.03783234    -0.01451286     0.09957095     0.00000000
     34     0.00000000     0.00000000     0.00000000    -0.00000005     0.32793578
     35     0.00637889     0.08852866    -0.04615477     0.23202226     0.00000000
     36     0.55870813    -0.47258629     0.01999971     0.19073999     0.00000001
     37    -0.01190346    -0.05551070     0.25272949    -0.28263712    -0.00000000
     38    -0.37681265     0.75172424    -1.94151514     2.12419672     0.00000003
     39     0.30613586    -1.65523564     1.13748974    -2.12755458    -0.00000004
     40    -0.00000002     0.00000004    -0.00000002    -0.00000048    -0.06573135
     41    -0.00000000     0.00000001    -0.00000000    -0.00000007     0.49523144
     42    -0.00584621     0.05672410     0.03019548     0.15490706     0.00000000
     43     0.00000006    -0.00000014     0.00000010     0.00000172     0.23873274
     44     0.00000001    -0.00000002     0.00000001     0.00000026    -1.79865412
     45     0.01182868    -0.22104816    -0.10040556    -0.57161033    -0.00000001
     46    -0.00000007     0.00000009    -0.00000002    -0.00000092    -0.12064895
     47    -0.00000001     0.00000001    -0.00000000    -0.00000014     0.90899027
     48    -0.02652459     0.11830090     0.04345077     0.30675952     0.00000001
     49     0.00457078    -0.00731963     0.01748412    -0.01389810    -0.00000000
     50     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     51    -0.00000000    -0.00000000    -0.00000000     0.00000000     0.00037922
     52     0.00457078    -0.00731963     0.01748412    -0.01389810     0.00000000
     53     0.00000000    -0.00000000     0.00000000     0.00000000    -0.00285708
     54     0.00474277    -0.00627805     0.01529388    -0.01264002    -0.00000000
     55     0.03407334    -0.07971805     0.22081940    -0.21562919     0.00000000
     56     0.00000000     0.00000000     0.00000000     0.00000000    -0.00000002
     57     0.00000000     0.00000001    -0.00000000    -0.00000001    -0.00100906
     58     0.03407334    -0.07971805     0.22081940    -0.21562919    -0.00000001
     59     0.00000000     0.00000000     0.00000000    -0.00000000     0.00760245
     60     0.03554485    -0.08232501     0.21219112    -0.22195827    -0.00000000
     61    -0.00000003     0.00000006    -0.00000004    -0.00000069    -0.09567952
     62    -0.00000000     0.00000000    -0.00000000    -0.00000005     0.32238116
     63    -0.00349300     0.03783234     0.01451286     0.09957095     0.00000000
     64    -0.00000001     0.00000003    -0.00000002    -0.00000031    -0.04278918
     65     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     66    -0.00000001     0.00000003    -0.00000002    -0.00000032    -0.04352644
     67    -0.00000000     0.00000001    -0.00000001    -0.00000010     0.72086620
     68    -0.00349300     0.03783234     0.01451286     0.09957095     0.00000000
     69    -0.00000000     0.00000000    -0.00000000    -0.00000005     0.32793578
     70    -0.00637889     0.08852866     0.04615477     0.23202226     0.00000000
                 6              7              8              9             10
      1     0.00000028    -0.13429454     0.00000000    -0.00000002    -0.31192447
      2    -0.00000025    -0.05460795     0.00000000    -0.00000003     0.31847528
      3     0.00000194     1.01586266    -0.00000007     0.00000079    -2.79194145
      4    -0.00000205    -0.35359354     0.00000003    -0.00000031    -0.90792969
      5    -0.49523144     0.00000059    -0.04333692    -0.63821348     0.00000003
      6    -0.06573135     0.00000009     0.63821348    -0.04333692     0.00000000
      7    -0.00000017    -0.60333262     0.00000005    -0.00000058    -0.70700283
      8     1.79865412    -0.00000215     0.15868054     2.33685406    -0.00000010
      9     0.23873274    -0.00000033    -2.33685406     0.15868054    -0.00000002
     10     0.00000063     2.18239672    -0.00000017     0.00000208     2.67041689
     11    -0.90899027     0.00000133    -0.09917666    -1.46055323     0.00000004
     12    -0.12064895     0.00000020     1.46055323    -0.09917666     0.00000001
     13    -0.00000041    -1.17475360     0.00000009    -0.00000109    -3.38594043
     14    -0.00000001    -0.00581486     0.00000000    -0.00000000    -0.01288719
     15     0.00000000     0.00000000    -0.00000000     0.00000000     0.00000000
     16    -0.00285708    -0.00000000     0.00030943     0.00455697     0.00000000
     17    -0.00000002    -0.00581486    -0.00000000    -0.00000001    -0.01288719
     18    -0.00037922    -0.00000000    -0.00455697     0.00030943     0.00000000
     19    -0.00000001    -0.01677110     0.00000000    -0.00000002     0.03577577
     20    -0.00000021    -0.07242023     0.00000000    -0.00000007     0.17211890
     21    -0.00000000     0.00000000     0.00000002    -0.00000000     0.00000000
     22     0.00760245    -0.00000000    -0.00144041    -0.02121259    -0.00000001
     23    -0.00000019    -0.07242023     0.00000001    -0.00000004     0.17211890
     24     0.00100906     0.00000000     0.02121259    -0.00144041    -0.00000000
     25    -0.00000021    -0.08878528     0.00000000    -0.00000005    -0.13762011
     26    -0.72086620     0.00000085    -0.06286784    -0.92584112     0.00000004
     27    -0.04278918     0.00000006     0.41404873    -0.02811535     0.00000000
     28    -0.00000011    -0.38560274     0.00000003    -0.00000037    -0.45000069
     29    -0.32238116     0.00000038    -0.02811535    -0.41404873     0.00000002
     30     0.00000000     0.00000000    -0.00000000     0.00000000     0.00000000
     31    -0.32793578     0.00000038    -0.02801027    -0.41250128     0.00000002
     32    -0.09567952     0.00000013     0.92584112    -0.06286784     0.00000001
     33    -0.00000011    -0.38560274     0.00000003    -0.00000037    -0.45000069
     34    -0.04352644     0.00000006     0.41250128    -0.02801027     0.00000000
     35    -0.00000025    -0.87497953     0.00000007    -0.00000084    -1.05116131
     36    -0.00000028    -0.13429454     0.00000000    -0.00000002     0.31192447
     37     0.00000025    -0.05460795     0.00000000    -0.00000003    -0.31847528
     38    -0.00000194     1.01586266    -0.00000007     0.00000079     2.79194145
     39     0.00000205    -0.35359354     0.00000003    -0.00000031     0.90792969
     40    -0.49523144    -0.00000059     0.04333692     0.63821348     0.00000003
     41    -0.06573135    -0.00000009    -0.63821348     0.04333692     0.00000000
     42    -0.00000017     0.60333262    -0.00000005     0.00000058    -0.70700283
     43     1.79865412     0.00000215    -0.15868054    -2.33685406    -0.00000010
     44     0.23873274     0.00000033     2.33685406    -0.15868054    -0.00000002
     45     0.00000063    -2.18239672     0.00000017    -0.00000208     2.67041689
     46    -0.90899027    -0.00000133     0.09917666     1.46055323     0.00000004
     47    -0.12064895    -0.00000020    -1.46055323     0.09917666     0.00000001
     48    -0.00000041     1.17475360    -0.00000009     0.00000109    -3.38594043
     49     0.00000001    -0.00581486     0.00000000    -0.00000000     0.01288719
     50    -0.00000000     0.00000000    -0.00000000     0.00000000     0.00000000
     51     0.00285708    -0.00000000     0.00030943     0.00455697    -0.00000000
     52     0.00000002    -0.00581486    -0.00000000    -0.00000001     0.01288719
     53     0.00037922    -0.00000000    -0.00455697     0.00030943    -0.00000000
     54     0.00000001    -0.01677110     0.00000000    -0.00000002    -0.03577577
     55     0.00000021    -0.07242023     0.00000000    -0.00000007    -0.17211890
     56     0.00000000     0.00000000     0.00000002    -0.00000000     0.00000000
     57    -0.00760245    -0.00000000    -0.00144041    -0.02121259     0.00000001
     58     0.00000019    -0.07242023     0.00000001    -0.00000004    -0.17211890
     59    -0.00100906     0.00000000     0.02121259    -0.00144041     0.00000000
     60     0.00000021    -0.08878528     0.00000000    -0.00000005     0.13762011
     61    -0.72086620    -0.00000085     0.06286784     0.92584112     0.00000004
     62    -0.04278918    -0.00000006    -0.41404873     0.02811535     0.00000000
     63    -0.00000011     0.38560274    -0.00000003     0.00000037    -0.45000069
     64    -0.32238116    -0.00000038     0.02811535     0.41404873     0.00000002
     65     0.00000000     0.00000000     0.00000000    -0.00000000     0.00000000
     66    -0.32793578    -0.00000038     0.02801027     0.41250128     0.00000002
     67    -0.09567952    -0.00000013    -0.92584112     0.06286784     0.00000001
     68    -0.00000011     0.38560274    -0.00000003     0.00000037    -0.45000069
     69    -0.04352644    -0.00000006    -0.41250128     0.02801027     0.00000000
     70    -0.00000025     0.87497953    -0.00000007     0.00000084    -1.05116131
                11             12             13             14             15
      1     1.99153264     1.98204407    -0.00000001    -0.00000013    -0.55422428
      2     0.96128482     1.25774379    -0.00000000    -0.00000005    -0.16873190
      3    -4.45526716    -6.66518008     0.00000002     0.00000017     1.16026624
      4     0.28656953     0.82168281    -0.00000000    -0.00000003    -0.06973784
      5     0.00000003    -0.00000004     0.08040983    -1.40225745     0.00000019
      6     0.00000000    -0.00000001    -1.40225745    -0.08040983     0.00000003
      7    -0.24809386     0.03039095    -0.00000000    -0.00000004    -1.44957077
      8    -0.00000007     0.00000019    -0.30371845     5.29650964    -0.00000073
      9    -0.00000001     0.00000003     5.29650964     0.30371845    -0.00000011
     10     0.95727688    -0.09140829     0.00000001     0.00000016     5.48158225
     11     0.00000004    -0.00000003     0.05536016    -0.96541922     0.00000018
     12     0.00000001    -0.00000000    -0.96541922    -0.05536016     0.00000003
     13    -0.22653955    -1.17612189    -0.00000001    -0.00000007    -1.18936771
     14     0.04485348     0.02989541     0.00000000    -0.00000000    -0.00559686
     15     0.00000000     0.00000000    -0.00000000    -0.00000000     0.00000000
     16     0.00000000    -0.00000000     0.00186870    -0.03258806    -0.00000000
     17     0.04485348     0.02989541    -0.00000000     0.00000000    -0.00559686
     18     0.00000000    -0.00000000    -0.03258806    -0.00186870     0.00000000
     19     0.03829564     0.05324191     0.00000000     0.00000000    -0.03433740
     20     0.71168674     0.83306281    -0.00000001     0.00000002    -0.14501891
     21     0.00000000     0.00000000     0.00000003     0.00000001     0.00000000
     22    -0.00000001     0.00000001    -0.01355903     0.23645424     0.00000003
     23     0.71168674     0.83306281     0.00000000    -0.00000004    -0.14501891
     24    -0.00000000     0.00000000     0.23645424     0.01355903     0.00000000
     25     0.71206000     0.64572859    -0.00000000    -0.00000004    -0.13837833
     26     0.00000004    -0.00000006     0.11847263    -2.06603000     0.00000028
     27     0.00000000    -0.00000000    -0.92395671    -0.05298257     0.00000002
     28    -0.14941863     0.02399297    -0.00000000    -0.00000002    -0.94008357
     29     0.00000002    -0.00000003     0.05298257    -0.92395671     0.00000013
     30     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     31     0.00000002    -0.00000003     0.05418642    -0.94495040     0.00000013
     32     0.00000001    -0.00000001    -2.06603000    -0.11847263     0.00000004
     33    -0.14941863     0.02399297    -0.00000000    -0.00000003    -0.94008357
     34     0.00000000    -0.00000000    -0.94495040    -0.05418642     0.00000002
     35    -0.37799781     0.05409187    -0.00000001    -0.00000006    -2.14102532
     36     1.99153264    -1.98204407     0.00000001     0.00000013    -0.55422428
     37     0.96128482    -1.25774379     0.00000000     0.00000005    -0.16873190
     38    -4.45526716     6.66518008    -0.00000002    -0.00000017     1.16026624
     39     0.28656953    -0.82168281     0.00000000     0.00000003    -0.06973784
     40    -0.00000003    -0.00000004     0.08040983    -1.40225745    -0.00000019
     41    -0.00000000    -0.00000001    -1.40225745    -0.08040983    -0.00000003
     42     0.24809386     0.03039095    -0.00000000    -0.00000004     1.44957077
     43     0.00000007     0.00000019    -0.30371845     5.29650964     0.00000073
     44     0.00000001     0.00000003     5.29650964     0.30371845     0.00000011
     45    -0.95727688    -0.09140829     0.00000001     0.00000016    -5.48158225
     46    -0.00000004    -0.00000003     0.05536016    -0.96541922    -0.00000018
     47    -0.00000001    -0.00000000    -0.96541922    -0.05536016    -0.00000003
     48     0.22653955    -1.17612189    -0.00000001    -0.00000007     1.18936771
     49     0.04485348    -0.02989541    -0.00000000     0.00000000    -0.00559686
     50     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     51     0.00000000     0.00000000    -0.00186870     0.03258806    -0.00000000
     52     0.04485348    -0.02989541     0.00000000    -0.00000000    -0.00559686
     53     0.00000000     0.00000000     0.03258806     0.00186870     0.00000000
     54     0.03829564    -0.05324191     0.00000000    -0.00000000    -0.03433740
     55     0.71168674    -0.83306281     0.00000001    -0.00000002    -0.14501891
     56     0.00000000     0.00000000    -0.00000003    -0.00000001     0.00000000
     57    -0.00000001    -0.00000001     0.01355903    -0.23645424     0.00000003
     58     0.71168674    -0.83306281    -0.00000000     0.00000004    -0.14501891
     59    -0.00000000    -0.00000000    -0.23645424    -0.01355903     0.00000000
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     66    -0.00000002    -0.00000003     0.05418642    -0.94495040    -0.00000013
     67    -0.00000001    -0.00000001    -2.06603000    -0.11847263    -0.00000004
     68     0.14941863     0.02399297    -0.00000000    -0.00000003     0.94008357
     69    -0.00000000    -0.00000000    -0.94495040    -0.05418642    -0.00000002
     70     0.37799781     0.05409187    -0.00000001    -0.00000006     2.14102532
                16             17             18             19             20
      1     0.00000000     0.00000000    -0.00000003     0.00000009     0.00000000
      2     0.00000000     0.00000000    -0.00000000     0.00000001     0.00000000
      3     0.00000000     0.00000000     0.00000002    -0.00000008    -0.00000000
      4     0.00000000     0.00000000     0.00000000    -0.00000001    -0.00000001
      5    -0.00000064     0.00000010    -0.23214922     1.67540470    -0.06910085
      6     0.00000010     0.00000064    -1.67540470    -0.23214922     0.74415416
      7     0.00000000     0.00000000    -0.00000005     0.00000018    -0.00000001
      8     0.00000243    -0.00000037     0.88159925    -6.36244023     0.25959951
      9    -0.00000037    -0.00000243     6.36244023     0.88159925    -2.79565401
     10     0.00000000     0.00000000     0.00000020    -0.00000067     0.00000004
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     12     0.00000009     0.00000057    -1.42818744    -0.19789404     0.38704161
     13     0.00000000     0.00000000    -0.00000004     0.00000015    -0.00000001
     14    -0.08870980     0.00008696    -0.00000000    -0.00000004    -0.00000000
     15     0.00010041     0.10243325     0.00000004    -0.00000000     0.00000001
     16     0.00000000    -0.00000000     0.00153470    -0.01107579     0.00749733
     17     0.08870980    -0.00008696     0.00000000     0.00000004     0.00000000
     18    -0.00000000    -0.00000000     0.01107579     0.00153470    -0.08073955
     19     0.00000000     0.00000000    -0.00000000     0.00000000     0.00000000
     20     0.61758282    -0.00060537     0.00000001     0.00000021     0.00000002
     21    -0.00069903    -0.71312321    -0.00000027     0.00000000    -0.00000011
     22    -0.00000002     0.00000000    -0.01084080     0.07823727    -0.05696610
     23    -0.61758282     0.00060537     0.00000000    -0.00000025    -0.00000002
     24     0.00000000     0.00000002    -0.07823727    -0.01084080     0.61347377
     25     0.00000000     0.00000000    -0.00000001     0.00000002    -0.00000000
     26    -0.00000093     0.00000014    -0.34062021     2.45823227    -0.10314451
     27     0.00000007     0.00000041    -1.09935489    -0.15232999     0.49675317
     28     0.00895710    -0.00000878    -0.00000003     0.00000012    -0.00000001
     29    -0.00000043     0.00000006    -0.15232999     1.09935489    -0.04612763
     30    -0.00001014    -0.01034277    -0.00000001     0.00000000     0.00000001
     31    -0.00000042     0.00000006    -0.15219856     1.09840637    -0.04352215
     32     0.00000014     0.00000095    -2.45823227    -0.34062021     1.11077386
     33    -0.00895710     0.00000878    -0.00000003     0.00000011    -0.00000001
     34     0.00000006     0.00000042    -1.09840637    -0.15219856     0.46869458
     35     0.00000000     0.00000000    -0.00000008     0.00000026    -0.00000002
     36     0.00000000     0.00000000    -0.00000003     0.00000009     0.00000000
     37     0.00000000     0.00000000    -0.00000000     0.00000001    -0.00000000
     38     0.00000000     0.00000000     0.00000002    -0.00000008     0.00000000
     39     0.00000000     0.00000000     0.00000000    -0.00000001     0.00000001
     40     0.00000064    -0.00000010     0.23214922    -1.67540470    -0.06910085
     41    -0.00000010    -0.00000064     1.67540470     0.23214922     0.74415416
     42     0.00000000     0.00000000     0.00000005    -0.00000018    -0.00000001
     43    -0.00000243     0.00000037    -0.88159925     6.36244023     0.25959951
     44     0.00000037     0.00000243    -6.36244023    -0.88159925    -2.79565401
     45     0.00000000     0.00000000    -0.00000020     0.00000067     0.00000004
     46     0.00000057    -0.00000009     0.19789404    -1.42818744    -0.03594000
     47    -0.00000009    -0.00000057     1.42818744     0.19789404     0.38704161
     48     0.00000000     0.00000000     0.00000004    -0.00000015    -0.00000001
     49    -0.08870980     0.00008696    -0.00000000    -0.00000004     0.00000000
     50     0.00010041     0.10243325     0.00000004    -0.00000000    -0.00000001
     51     0.00000000    -0.00000000     0.00153470    -0.01107579    -0.00749733
     52     0.08870980    -0.00008696     0.00000000     0.00000004    -0.00000000
     53    -0.00000000    -0.00000000     0.01107579     0.00153470     0.08073955
     54     0.00000000     0.00000000    -0.00000000     0.00000000     0.00000000
     55     0.61758282    -0.00060537     0.00000001     0.00000021    -0.00000002
     56    -0.00069903    -0.71312321    -0.00000027     0.00000000     0.00000011
     57    -0.00000002     0.00000000    -0.01084080     0.07823727     0.05696610
     58    -0.61758282     0.00060537     0.00000000    -0.00000025     0.00000002
     59     0.00000000     0.00000002    -0.07823727    -0.01084080    -0.61347377
     60     0.00000000     0.00000000    -0.00000001     0.00000002     0.00000000
     61     0.00000093    -0.00000014     0.34062021    -2.45823227    -0.10314451
     62    -0.00000007    -0.00000041     1.09935489     0.15232999     0.49675317
     63    -0.00895710     0.00000878     0.00000003    -0.00000012    -0.00000001
     64     0.00000043    -0.00000006     0.15232999    -1.09935489    -0.04612763
     65     0.00001014     0.01034277     0.00000001     0.00000000     0.00000001
     66     0.00000042    -0.00000006     0.15219856    -1.09840637    -0.04352215
     67    -0.00000014    -0.00000095     2.45823227     0.34062021     1.11077386
     68     0.00895710    -0.00000878     0.00000003    -0.00000011    -0.00000001
     69    -0.00000006    -0.00000042     1.09840637     0.15219856     0.46869458
     70     0.00000000     0.00000000     0.00000008    -0.00000026    -0.00000002
                21             22             23             24             25
      1     0.00000000     0.00000000     0.00000000    -0.09015488     0.38212888
      2    -0.00000002     0.00000000     0.00000000     0.26696050     0.47064509
      3     0.00000001     0.00000000     0.00000000    -1.45312430    -1.08329131
      4     0.00000011     0.00000000     0.00000000    -0.82734894    -0.04250633
      5    -0.74415416     0.00000014    -0.00000002    -0.00000003     0.00000004
      6    -0.06910085    -0.00000002    -0.00000014    -0.00000000     0.00000001
      7     0.00000018     0.00000000     0.00000000    -1.47007385    -0.85394814
      8     2.79565401    -0.00000055     0.00000008     0.00000012    -0.00000015
      9     0.25959951     0.00000008     0.00000055     0.00000002    -0.00000002
     10    -0.00000070     0.00000000     0.00000000     5.76790754     3.15429287
     11    -0.38704161     0.00000007    -0.00000001    -0.00000002     0.00000010
     12    -0.03594000    -0.00000001    -0.00000007    -0.00000000     0.00000002
     13     0.00000024     0.00000000     0.00000000    -2.85558851    -0.83767062
     14    -0.00000001    -0.09336232     0.00012810    -0.03967725    -0.04243077
     15    -0.00000000     0.00014792     0.10780552     0.00000000     0.00000000
     16     0.08073955    -0.00000001     0.00000000     0.00000001    -0.00000002
     17     0.00000001     0.09336232    -0.00012810    -0.03967725    -0.04243077
     18     0.00749733     0.00000000     0.00000001     0.00000000    -0.00000000
     19    -0.00000000     0.00000000     0.00000000     0.06856765     0.10052512
     20     0.00000011     0.71246965    -0.00097755     0.11297618     0.75424070
     21     0.00000003    -0.00112878    -0.82268909     0.00000000     0.00000000
     22    -0.61347377     0.00000007    -0.00000001    -0.00000006     0.00000017
     23    -0.00000007    -0.71246965     0.00097755     0.11297618     0.75424070
     24    -0.05696610    -0.00000001    -0.00000007    -0.00000001     0.00000003
     25     0.00000003     0.00000000     0.00000000    -0.82629432    -0.58073806
     26    -1.11077386     0.00000022    -0.00000003    -0.00000004     0.00000006
     27    -0.04612763    -0.00000001    -0.00000011    -0.00000000     0.00000000
     28     0.00000011    -0.01067792     0.00001465    -0.94600694    -0.57431810
     29    -0.49675317     0.00000009    -0.00000002    -0.00000002     0.00000003
     30    -0.00000000     0.00001692     0.01232980     0.00000000     0.00000000
     31    -0.46869458     0.00000009    -0.00000001    -0.00000002     0.00000002
     32    -0.10314451    -0.00000003    -0.00000021    -0.00000001     0.00000001
     33     0.00000012     0.01067792    -0.00001465    -0.94600694    -0.57431810
     34    -0.04352215    -0.00000001    -0.00000009    -0.00000000     0.00000000
     35     0.00000027     0.00000000     0.00000000    -2.24235229    -1.16564983
     36     0.00000000     0.00000000     0.00000000     0.09015488     0.38212888
     37     0.00000002     0.00000000     0.00000000    -0.26696050     0.47064509
     38    -0.00000001     0.00000000     0.00000000     1.45312430    -1.08329131
     39    -0.00000011     0.00000000     0.00000000     0.82734894    -0.04250633
     40    -0.74415416     0.00000014    -0.00000002    -0.00000003    -0.00000004
     41    -0.06910085    -0.00000002    -0.00000014    -0.00000000    -0.00000001
     42     0.00000018     0.00000000     0.00000000    -1.47007385     0.85394814
     43     2.79565401    -0.00000055     0.00000008     0.00000012     0.00000015
     44     0.25959951     0.00000008     0.00000055     0.00000002     0.00000002
     45    -0.00000070     0.00000000     0.00000000     5.76790754    -3.15429287
     46    -0.38704161     0.00000007    -0.00000001    -0.00000002    -0.00000010
     47    -0.03594000    -0.00000001    -0.00000007    -0.00000000    -0.00000002
     48     0.00000024     0.00000000     0.00000000    -2.85558851     0.83767062
     49     0.00000001     0.09336232    -0.00012810     0.03967725    -0.04243077
     50     0.00000000    -0.00014792    -0.10780552     0.00000000     0.00000000
     51    -0.08073955     0.00000001    -0.00000000    -0.00000001    -0.00000002
     52    -0.00000001    -0.09336232     0.00012810     0.03967725    -0.04243077
     53    -0.00749733    -0.00000000    -0.00000001    -0.00000000    -0.00000000
     54     0.00000000     0.00000000     0.00000000    -0.06856765     0.10052512
     55    -0.00000011    -0.71246965     0.00097755    -0.11297618     0.75424070
     56    -0.00000003     0.00112878     0.82268909     0.00000000     0.00000000
     57     0.61347377    -0.00000007     0.00000001     0.00000006     0.00000017
     58     0.00000007     0.71246965    -0.00097755    -0.11297618     0.75424070
     59     0.05696610     0.00000001     0.00000007     0.00000001     0.00000003
     60    -0.00000003     0.00000000     0.00000000     0.82629432    -0.58073806
     61    -1.11077386     0.00000022    -0.00000003    -0.00000004    -0.00000006
     62    -0.04612763    -0.00000001    -0.00000011    -0.00000000    -0.00000000
     63     0.00000011    -0.01067792     0.00001465    -0.94600694     0.57431810
     64    -0.49675317     0.00000009    -0.00000002    -0.00000002    -0.00000003
     65    -0.00000000     0.00001692     0.01232980     0.00000000     0.00000000
     66    -0.46869458     0.00000009    -0.00000001    -0.00000002    -0.00000002
     67    -0.10314451    -0.00000003    -0.00000021    -0.00000001    -0.00000001
     68     0.00000012     0.01067792    -0.00001465    -0.94600694     0.57431810
     69    -0.04352215    -0.00000001    -0.00000009    -0.00000000    -0.00000000
     70     0.00000027     0.00000000     0.00000000    -2.24235229     1.16564983
                26             27             28             29             30
      1    -0.00000002    -0.00000010     1.13999618    -0.96052444     0.55917590
      2    -0.00000001    -0.00000005    -0.19287850    -0.24328206     0.01636412
      3     0.00000007     0.00000032    -3.96366733     6.24348647     0.58758175
      4    -0.00000000    -0.00000001     0.26521490    -0.55326516     0.23501313
      5    -0.00647835    -0.11764869    -0.00000003     0.00000001    -0.00000007
      6    -0.11764869     0.00647835    -0.00000000     0.00000000    -0.00000001
      7     0.00000003     0.00000012     0.25489742    -0.25015149    -1.28683805
      8     0.02346030     0.42604574     0.00000006     0.00000003     0.00000021
      9     0.42604574    -0.02346030     0.00000001     0.00000000     0.00000003
     10    -0.00000010    -0.00000047    -0.90592207     0.90946184     5.36134815
     11     0.02573681     0.46738781     0.00000003    -0.00000001    -0.00000002
     12     0.46738781    -0.02573681     0.00000000    -0.00000000    -0.00000000
     13     0.00000002     0.00000011     0.15086166     1.59515848     1.72763905
     14     0.00000000     0.00000000     0.08532813    -0.03494321     0.08580628
     15     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     16    -0.00719544    -0.13067118    -0.00000001     0.00000000     0.00000001
     17     0.00000000     0.00000000     0.08532813    -0.03494321     0.08580628
     18    -0.13067118     0.00719544    -0.00000000     0.00000000     0.00000000
     19    -0.00000000    -0.00000002     0.08639371    -0.14657476    -0.14473987
     20    -0.00000003    -0.00000017     1.30899152    -1.61079667     0.04518242
     21    -0.00000001    -0.00000000     0.00000000     0.00000000     0.00000000
     22     0.06368309     1.15650309     0.00000006    -0.00000001    -0.00000001
     23    -0.00000003    -0.00000016     1.30899152    -1.61079667     0.04518242
     24     1.15650309    -0.06368309     0.00000001    -0.00000000    -0.00000000
     25     0.00000001     0.00000003     1.25041531    -0.30512524     3.06039336
     26    -0.00911945    -0.16561178    -0.00000003    -0.00000001    -0.00000010
     27    -0.07406384     0.00407834    -0.00000000    -0.00000000    -0.00000001
     28     0.00000002     0.00000010     0.19301379    -0.16492880    -0.77697782
     29    -0.00407834    -0.07406384    -0.00000002    -0.00000000    -0.00000005
     30     0.00000001     0.00000000     0.00000000     0.00000000     0.00000000
     31    -0.00503992    -0.09152641    -0.00000002     0.00000001    -0.00000004
     32    -0.16561178     0.00911945    -0.00000001    -0.00000000    -0.00000002
     33     0.00000002     0.00000008     0.19301379    -0.16492880    -0.77697782
     34    -0.09152641     0.00503992    -0.00000000     0.00000000    -0.00000001
     35     0.00000004     0.00000017     0.33385013    -0.33310358    -1.67036216
     36    -0.00000002    -0.00000010     1.13999618     0.96052444    -0.55917590
     37    -0.00000001    -0.00000005    -0.19287850     0.24328206    -0.01636412
     38     0.00000007     0.00000032    -3.96366733    -6.24348647    -0.58758175
     39    -0.00000000    -0.00000001     0.26521490     0.55326516    -0.23501313
     40     0.00647835     0.11764869     0.00000003     0.00000001    -0.00000007
     41     0.11764869    -0.00647835     0.00000000     0.00000000    -0.00000001
     42    -0.00000003    -0.00000012    -0.25489742    -0.25015149    -1.28683805
     43    -0.02346030    -0.42604574    -0.00000006     0.00000003     0.00000021
     44    -0.42604574     0.02346030    -0.00000001     0.00000000     0.00000003
     45     0.00000010     0.00000047     0.90592207     0.90946184     5.36134815
     46    -0.02573681    -0.46738781    -0.00000003    -0.00000001    -0.00000002
     47    -0.46738781     0.02573681    -0.00000000    -0.00000000    -0.00000000
     48    -0.00000002    -0.00000011    -0.15086166     1.59515848     1.72763905
     49     0.00000000     0.00000000     0.08532813     0.03494321    -0.08580628
     50     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     51    -0.00719544    -0.13067118    -0.00000001    -0.00000000    -0.00000001
     52     0.00000000     0.00000000     0.08532813     0.03494321    -0.08580628
     53    -0.13067118     0.00719544    -0.00000000    -0.00000000    -0.00000000
     54    -0.00000000    -0.00000002     0.08639371     0.14657476     0.14473987
     55    -0.00000003    -0.00000017     1.30899152     1.61079667    -0.04518242
     56    -0.00000001    -0.00000000     0.00000000     0.00000000     0.00000000
     57     0.06368309     1.15650309     0.00000006     0.00000001     0.00000001
     58    -0.00000003    -0.00000016     1.30899152     1.61079667    -0.04518242
     59     1.15650309    -0.06368309     0.00000001     0.00000000     0.00000000
     60     0.00000001     0.00000003     1.25041531     0.30512524    -3.06039336
     61     0.00911945     0.16561178     0.00000003    -0.00000001    -0.00000010
     62     0.07406384    -0.00407834     0.00000000    -0.00000000    -0.00000001
     63    -0.00000002    -0.00000010    -0.19301379    -0.16492880    -0.77697782
     64     0.00407834     0.07406384     0.00000002    -0.00000000    -0.00000005
     65    -0.00000001    -0.00000000     0.00000000     0.00000000     0.00000000
     66     0.00503992     0.09152641     0.00000002     0.00000001    -0.00000004
     67     0.16561178    -0.00911945     0.00000001    -0.00000000    -0.00000002
     68    -0.00000002    -0.00000008    -0.19301379    -0.16492880    -0.77697782
     69     0.09152641    -0.00503992     0.00000000     0.00000000    -0.00000001
     70    -0.00000004    -0.00000017    -0.33385013    -0.33310358    -1.67036216
                31             32             33             34             35
      1     0.35197176    -0.00000000    -0.00000007     0.00000005    -0.00000009
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      4    -0.14317113     0.00000000     0.00000002    -0.00000002     0.00000003
      5     0.00000032    -0.41091643     2.78865402    -1.09034342     2.96174288
      6     0.00000005     2.78865402     0.41091643    -2.96174288    -1.09034342
      7    -2.99812210    -0.00000000    -0.00000009    -0.00000015     0.00000028
      8    -0.00000102     1.27577601    -8.65795961     3.43078019    -9.31916370
      9    -0.00000015    -8.65795961    -1.27577601     9.31916370     3.43078019
     10     9.31750432     0.00000000     0.00000034     0.00000048    -0.00000087
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     12     0.00000002     0.80965852     0.11930558    -1.06898379    -0.39353836
     13    -0.99070260     0.00000000     0.00000002    -0.00000005     0.00000009
     14     0.04753293    -0.00000000     0.00000001    -0.00000000     0.00000001
     15     0.00000000     0.00000001     0.00000000    -0.00000001    -0.00000000
     16    -0.00000000    -0.00116996     0.00793987    -0.00530284     0.01440430
     17     0.04753293     0.00000000    -0.00000000     0.00000000    -0.00000001
     18    -0.00000000     0.00793987     0.00116996    -0.01440430    -0.00530284
     19    -0.13666402     0.00000000    -0.00000001    -0.00000001     0.00000001
     20    -0.02229820     0.00000000     0.00000001    -0.00000001     0.00000001
     21     0.00000000    -0.00000000    -0.00000000     0.00000000     0.00000000
     22    -0.00000001    -0.00493335     0.03347984     0.03369089    -0.09151590
     23    -0.02229820    -0.00000000     0.00000002    -0.00000001     0.00000002
     24    -0.00000000     0.03347984     0.00493335     0.09151590     0.03369089
     25     0.12714075     0.00000000     0.00000010    -0.00000000     0.00000000
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     17     0.74266169     0.01073921    -0.75842703    -0.00000003     0.00000006
     18     0.00000000    -0.00000007     0.00000001    -0.81284727    -0.31743400
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     27    -0.00000001    -0.00000004     0.00000000    -0.00290747    -0.00113543
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     29     0.00000005    -0.00000001    -0.00000002     0.00113543    -0.00290747
     30     0.00047040    -0.10344703    -0.00146479     0.00000002     0.00000001
     31     0.00000001    -0.00000000    -0.00000002    -0.04329040     0.11085291
     32    -0.00000002    -0.00000007     0.00000001    -0.00650131    -0.00253890
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     41     0.00000001    -0.00000003     0.00000000     0.02388544     0.00932777
     42     0.00000000     0.00000000     0.00000000     0.00000001    -0.00000004
     43     0.00000025     0.00000002     0.00000012     0.05221335    -0.13370174
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     65    -0.00047040    -0.10344703    -0.00146479     0.00000002     0.00000001
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     67     0.00000002    -0.00000007     0.00000001    -0.00650131    -0.00253890
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                56             57             58             59             60
      1    -0.00000003     0.00000006    -0.39665013    -4.47962302     2.66775432
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      3     0.00000002    -0.00000005     2.22179095     3.32591600    -2.86743022
      4     0.00000001    -0.00000001     0.20426681     1.17305855    -0.55719883
      5     0.08481528    -0.28712592    -0.00000002    -0.00000003    -0.00000001
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      7    -0.00000002     0.00000004    -0.35715714    -0.43753657     4.03523290
      8    -0.30882066     1.04545333     0.00000011     0.00000011     0.00000012
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     12    -0.23357457    -0.06899653    -0.00000000    -0.00000000    -0.00000000
     13    -0.00000000     0.00000001     1.56679318     0.12190037    -0.52954483
     14     0.00000000     0.00000000     0.34953226     0.57765694    -0.20162557
     15    -0.00000000    -0.00000000     0.00000000     0.00000000     0.00000000
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     18     0.82752849     0.24444697     0.00000000    -0.00000000    -0.00000000
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     20    -0.00000000     0.00000001    -0.52564026    -0.70995351     0.37237157
     21     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
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     24    -0.90059143    -0.26602932    -0.00000000     0.00000000     0.00000000
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     34    -0.29946503    -0.08846018    -0.00000000    -0.00000000    -0.00000000
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     37     0.00000001    -0.00000001    -0.25970366     0.64637896     1.22388132
     38     0.00000002    -0.00000005    -2.22179095     3.32591600     2.86743022
     39     0.00000001    -0.00000001    -0.20426681     1.17305855     0.55719883
     40    -0.08481528     0.28712592    -0.00000002     0.00000003    -0.00000001
     41    -0.28712592    -0.08481528    -0.00000000     0.00000001    -0.00000000
     42     0.00000002    -0.00000004    -0.35715714     0.43753657     4.03523290
     43     0.30882066    -1.04545333     0.00000011    -0.00000011     0.00000012
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     46     0.06899653    -0.23357457    -0.00000001     0.00000000    -0.00000001
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     50    -0.00000000    -0.00000000     0.00000000     0.00000000     0.00000000
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     53     0.82752849     0.24444697    -0.00000000    -0.00000000     0.00000000
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     55    -0.00000000     0.00000001     0.52564026    -0.70995351    -0.37237157
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     59    -0.90059143    -0.26602932     0.00000000     0.00000000    -0.00000000
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     68     0.00000002    -0.00000004     0.00941220     0.65031594     3.64746796
     69     0.29946503     0.08846018    -0.00000000     0.00000000    -0.00000000
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                61             62             63             64             65
      1     0.00000009     0.00000083     2.16349113    -9.09794839    -0.00000053
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      7    -0.00000003    -0.00000028    -1.20492765     1.90622909     0.00000006
      8     1.58458884     5.98976519    -0.00000034     0.00000059    -4.40479381
      9    -5.98976519     1.58458884    -0.00000005     0.00000009    -5.18893200
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     11    -0.10866692    -0.41076230     0.00000003    -0.00000004     0.38277509
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     13    -0.00000000    -0.00000001    -0.50649008    -0.04071742     0.00000001
     14    -0.00000001    -0.00000004    -0.15104184     0.49462915     0.00000001
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     16    -0.00404114    -0.01527556    -0.00000001    -0.00000000    -0.01510956
     17    -0.00000000    -0.00000003    -0.15104184     0.49462915     0.00000001
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     19    -0.00000000    -0.00000003    -0.12500427     0.46791641     0.00000004
     20     0.00000001     0.00000007     0.10936757    -0.63016087    -0.00000003
     21    -0.00000001     0.00000000     0.00000000     0.00000000    -0.00000000
     22    -0.00227776    -0.00860995     0.00000001    -0.00000000     0.01024379
     23     0.00000001     0.00000006     0.10936757    -0.63016087    -0.00000003
     24     0.00860995    -0.00227776     0.00000000     0.00000000     0.01206739
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     26    -0.90112594    -3.40626707     0.00000019    -0.00000033     2.41912488
     27     1.52332895    -0.40299577     0.00000001    -0.00000002     1.27445845
     28    -0.00000003    -0.00000023    -1.83408365     1.48343985     0.00000008
     29    -0.40299577    -1.52332895     0.00000008    -0.00000015     1.08186554
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     33    -0.00000003    -0.00000023    -1.83408365     1.48343985     0.00000007
     34     1.48628045    -0.39319461     0.00000001    -0.00000002     1.31283144
     35    -0.00000004    -0.00000036    -3.64909668     2.26537368     0.00000012
     36    -0.00000009    -0.00000083     2.16349113     9.09794839    -0.00000053
     37     0.00000001     0.00000013    -0.52574793    -1.36318348     0.00000014
     38     0.00000006     0.00000059    -1.24603040    -6.21380565     0.00000034
     39     0.00000002     0.00000021    -0.62532985    -2.28979864     0.00000014
     40    -0.23266093    -0.87946116    -0.00000006    -0.00000009    -0.69668657
     41     0.87946116    -0.23266093    -0.00000001    -0.00000001    -0.82071021
     42    -0.00000003    -0.00000028     1.20492765     1.90622909    -0.00000006
     43     1.58458884     5.98976519     0.00000034     0.00000059     4.40479381
     44    -5.98976519     1.58458884     0.00000005     0.00000009     5.18893200
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     46    -0.10866692    -0.41076230    -0.00000003    -0.00000004    -0.38277509
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     48    -0.00000000    -0.00000001     0.50649008    -0.04071742    -0.00000001
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     50    -0.00000001     0.00000000     0.00000000     0.00000000     0.00000001
     51     0.00404114     0.01527556    -0.00000001     0.00000000    -0.01510956
     52     0.00000000     0.00000003    -0.15104184    -0.49462915     0.00000001
     53    -0.01527556     0.00404114    -0.00000000     0.00000000    -0.01779935
     54     0.00000000     0.00000003    -0.12500427    -0.46791641     0.00000004
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     56     0.00000001    -0.00000000     0.00000000     0.00000000    -0.00000000
     57     0.00227776     0.00860995     0.00000001     0.00000000     0.01024379
     58    -0.00000001    -0.00000006     0.10936757     0.63016087    -0.00000003
     59    -0.00860995     0.00227776     0.00000000     0.00000000     0.01206739
     60    -0.00000003    -0.00000028     0.17116933     2.26770704    -0.00000005
     61    -0.90112594    -3.40626707    -0.00000019    -0.00000033    -2.41912488
     62     1.52332895    -0.40299577    -0.00000001    -0.00000002    -1.27445845
     63    -0.00000003    -0.00000023     1.83408365     1.48343985    -0.00000008
     64    -0.40299577    -1.52332895    -0.00000008    -0.00000015    -1.08186554
     65     0.00000000     0.00000000     0.00000000     0.00000000    -0.00000000
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     67     3.40626707    -0.90112594    -0.00000003    -0.00000005    -2.84977573
     68    -0.00000003    -0.00000023     1.83408365     1.48343985    -0.00000007
     69     1.48628045    -0.39319461    -0.00000001    -0.00000002    -1.31283144
     70    -0.00000004    -0.00000036     3.64909668     2.26537368    -0.00000012
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      1    -0.00000046     9.10161246     0.64848063   -54.51570042   -57.45338059
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      5     0.82071021     0.00000007     0.00000000    -0.00000000    -0.00000000
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      7     0.00000005    -0.14076207    -0.93610487     0.10999576     0.63610398
      8    -5.18893200    -0.00000040    -0.00000001     0.00000001     0.00000001
      9     4.40479381    -0.00000006    -0.00000000     0.00000000     0.00000000
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     11     0.45091644     0.00000004     0.00000000    -0.00000000    -0.00000000
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     14     0.00000001    -0.17683760     0.09034137    -3.52401985    -3.68159888
     15    -0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
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     26     2.84977573     0.00000022     0.00000000    -0.00000001    -0.00000001
     27    -1.08186554     0.00000001     0.00000000    -0.00000000    -0.00000000
     28     0.00000007    -0.06833994    -0.15185357     0.15119781     0.46170025
     29     1.27445845     0.00000010     0.00000000    -0.00000000    -0.00000000
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     38     0.00000029    -5.74111565    -0.13913307    31.89445413   -34.83808430
     39     0.00000012    -2.46739169    -0.08526732    15.45005994   -15.91625048
     40    -0.82071021    -0.00000007     0.00000000     0.00000000    -0.00000000
     41     0.69668657    -0.00000001     0.00000000     0.00000000    -0.00000000
     42    -0.00000005     0.14076207    -0.93610487    -0.10999576     0.63610398
     43     5.18893200     0.00000040    -0.00000001    -0.00000001     0.00000001
     44    -4.40479381     0.00000006    -0.00000000    -0.00000000     0.00000000
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     46    -0.45091644    -0.00000004     0.00000000     0.00000000    -0.00000000
     47     0.38277509    -0.00000001     0.00000000     0.00000000     0.00000000
     48    -0.00000001    -0.17874042     1.19403078     0.05414855     0.60895631
     49     0.00000001    -0.17683760    -0.09034137    -3.52401985     3.68159888
     50    -0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     51    -0.01779935    -0.00000000    -0.00000001     0.00000000     0.00000000
     52     0.00000000    -0.17683760    -0.09034137    -3.52401985     3.68159888
     53     0.01510956     0.00000000    -0.00000000     0.00000000     0.00000000
     54     0.00000003    -0.81494306    -0.30283345    -3.51730962     3.59626555
     55    -0.00000003     0.37628988    -0.04369842    -3.26808330     3.57044821
     56     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     57     0.01206739     0.00000000     0.00000000     0.00000000     0.00000000
     58    -0.00000002     0.37628988    -0.04369842    -3.26808330     3.57044821
     59    -0.01024379     0.00000000     0.00000000     0.00000000     0.00000000
     60    -0.00000005     0.87118551    -2.16285963    -3.30698825     3.65323124
     61    -2.84977573    -0.00000022     0.00000000     0.00000001    -0.00000001
     62     1.08186554    -0.00000001     0.00000000     0.00000000    -0.00000000
     63    -0.00000007     0.06833994    -0.15185357    -0.15119781     0.46170025
     64    -1.27445845    -0.00000010     0.00000000     0.00000000    -0.00000000
     65     0.00000000     0.00000000     0.00000000     0.00000000     0.00000000
     66    -1.31283144    -0.00000010    -0.00000000     0.00000000    -0.00000000
     67     2.41912488    -0.00000003     0.00000000     0.00000000    -0.00000000
     68    -0.00000007     0.06833994    -0.15185357    -0.15119781     0.46170025
     69     1.11443970    -0.00000002    -0.00000000     0.00000000    -0.00000000
     70    -0.00000011    -0.43034512     1.63302899    -0.02661512     1.35118857

           ---------------------------------------
                  UHF spin-up   orbital energies  
           ---------------------------------------
                 1
      1    -0.66317135
      2    -0.35456257
      3     0.20892440
      4     0.27692429
      5     0.38896947
      6     0.38896947
      7     0.58117482
      8     0.63590687
      9     0.63590687
     10     0.95230232
     11     1.08954652
     12     1.17882372
     13     1.66520914
     14     1.66520914
     15     1.69061670
     16     1.88864326
     17     1.88864326
     18     1.95241796
     19     1.95241796
     20     2.03680535
     21     2.03680535
     22     2.25491483
     23     2.25491483
     24     2.34654076
     25     2.74858810
     26     2.87088129
     27     2.87088129
     28     3.04250043
     29     3.08477569
     30     3.97694495
     31     4.37671248
     32     4.38828662
     33     4.38828662
     34     4.51449721
     35     4.51449721
     36     5.02006978
     37     5.64086206
     38     5.64086206
     39     5.67706716
     40     5.67706716
     41     5.94917986
     42     5.94917986
     43     6.12242289
     44     6.12242289
     45     6.41413781
     46     6.61948580
     47     6.61948580
     48     7.83013448
     49     7.83013448
     50     8.05805677
     51     8.05805677
     52     8.21654596
     53     8.21654596
     54     8.29335509
     55     8.29335509
     56     8.56217794
     57     8.56217794
     58     8.64078983
     59     9.07690247
     60     9.26609256
     61     9.63721116
     62     9.63721116
     63     9.65436690
     64     9.71898863
     65     9.77185145
     66     9.77185145
     67    10.01251795
     68    10.95221904
     69    22.63733132
     70    24.23655792

           ---------------------------------------
                  UHF spin-down orbital energies  
           ---------------------------------------
                 1
      1    -0.01676787
      2     0.14189789
      3     0.28830638
      4     0.43555618
      5     0.46301224
      6     0.46301224
      7     0.67725945
      8     0.70047115
      9     0.70047115
     10     1.01201591
     11     1.17427490
     12     1.26830936
     13     1.73319279
     14     1.73319279
     15     1.78998968
     16     1.93599217
     17     1.93599217
     18     2.02667058
     19     2.02667058
     20     2.09705501
     21     2.09705501
     22     2.30035895
     23     2.30035895
     24     2.42034641
     25     2.79671473
     26     2.91255939
     27     2.91255939
     28     3.12912166
     29     3.15451549
     30     4.02789208
     31     4.42250815
     32     4.44003511
     33     4.44003511
     34     4.56415727
     35     4.56415727
     36     5.06282975
     37     5.67733323
     38     5.67733323
     39     5.71540014
     40     5.71540014
     41     5.98259605
     42     5.98259605
     43     6.15529425
     44     6.15529425
     45     6.46046828
     46     6.65214581
     47     6.65214581
     48     7.86502864
     49     7.86502864
     50     8.10524917
     51     8.10524917
     52     8.26260636
     53     8.26260636
     54     8.33996883
     55     8.33996883
     56     8.60312515
     57     8.60312515
     58     8.68727486
     59     9.12332739
     60     9.29898718
     61     9.68375231
     62     9.68375231
     63     9.70209987
     64     9.77964277
     65     9.81739648
     66     9.81739648
     67    10.07022374
     68    10.99222910
     69    22.65086951
     70    24.25111558

                                        Total CPU time for UHF =      1.491 seconds


 AO to MO transformation... Please be patient

                    Total CPU time for AO to MO transformation =     14.934 seconds


 ************************************************
 |          One-shot G0W0 calculation           |
 |         *** Unrestricted version ***         |
 ************************************************

 Tamm-Dancoff approximation activated!


 -------------------------------------------------------------
   RPA@UHF      calculation: spin-conserved manifold
 -------------------------------------------------------------
 | State |  Excitation energy (au) |  Excitation energy (eV) |
 -------------------------------------------------------------
 |     1 |                0.576405 |               15.684789 |
 |     2 |                0.663839 |               18.063986 |
 |     3 |                0.765141 |               20.820535 |
 |     4 |                0.765141 |               20.820535 |
 |     5 |                0.899115 |               24.466179 |
 |     6 |                0.958154 |               26.072689 |
 |     7 |                0.996445 |               27.114644 |
 |     8 |                1.013792 |               27.586677 |
 |     9 |                1.013792 |               27.586677 |
 |    10 |                1.117092 |               30.397614 |
 |    11 |                1.117092 |               30.397614 |
 |    12 |                1.270749 |               34.578834 |
 |    13 |                1.321176 |               35.951024 |
 |    14 |                1.321176 |               35.951024 |
 |    15 |                1.352899 |               36.814259 |
 |    16 |                1.467124 |               39.922483 |
 |    17 |                1.564731 |               42.578496 |
 |    18 |                1.637563 |               44.560361 |
 |    19 |                1.801911 |               49.032509 |
 |    20 |                1.873953 |               50.992867 |
 -------------------------------------------------------------

  *** Quasiparticle energies obtained by linearization *** 

 --------------------------------------------------------------------------------------------------------------------------------
   Unrestricted one-shot G0W0 calculation (eV)
 --------------------------------------------------------------------------------------------------------------------------------
|   |              e_HF            |             Sig_c            |                 Z            |              e_QP            |
|  #|        up             dw     |        up             dw     |        up             dw     |        up             dw     |
 --------------------------------------------------------------------------------------------------------------------------------
|  1|     -18.045812      -0.456277|       0.456576      -1.261765|       0.943472       0.970306|     -17.615046      -1.680575|
|  2|      -9.648139       3.861238|      -0.040943      -0.582228|       0.964914       0.985561|      -9.687646       3.287417|
|  3|       5.685123       7.845216|      -0.169965      -0.891090|       0.993765       0.970039|       5.516218       6.980824|
|  4|       7.535494      11.852087|      -0.165421      -1.434610|       0.992831       0.947074|       7.371259      10.493406|
|  5|      10.584398      12.599205|      -0.458593      -0.776437|       0.984785       0.973653|      10.132783      11.843225|
|  6|      10.584398      12.599205|      -0.458593      -0.776437|       0.984785       0.973653|      10.132783      11.843225|
|  7|      15.814572      18.429168|      -0.485871      -0.897736|       0.984349       0.912263|      15.336306      17.610197|
|  8|      17.303907      19.060791|      -0.403214      -0.930957|       0.985311       0.804671|      16.906616      18.311677|
|  9|      17.303907      19.060791|      -0.403214      -0.930957|       0.985311       0.804671|      16.906616      18.311677|
| 10|      25.913466      27.538356|      -0.267177      -0.783483|       0.500133       0.842780|      25.779842      26.878052|
| 11|      29.648071      31.953648|      -1.456432      -2.904263|       0.488099       0.187973|      28.937189      31.407726|
| 12|      32.077427      34.512456|       0.706133      -2.063540|       0.127673       0.256121|      32.167581      33.983940|
| 13|      45.312649      47.162578|      -0.798113      -1.622602|       0.335470       0.569237|      45.044906      46.238933|
| 14|      45.312649      47.162578|      -0.798113      -1.622602|       0.335470       0.569237|      45.044906      46.238933|
| 15|      46.004024      48.708100|      -0.929900      -1.054189|       0.874695       0.548198|      45.190645      48.130195|
| 16|      51.392601      52.681030|      -0.820014      -0.833874|       0.820911       0.857573|      50.719442      51.965923|
| 17|      51.392601      52.681030|      -0.820014      -0.833874|       0.820911       0.857573|      50.719442      51.965923|
| 18|      53.127999      55.148515|      -1.261539      -0.512436|       0.766946       0.189746|      52.160466      55.051283|
| 19|      53.127999      55.148515|      -1.261539      -0.512436|       0.766946       0.189746|      52.160466      55.051283|
| 20|      55.424297      57.063773|      -0.651014      -0.763945|       0.906958       0.895240|      54.833854      56.379859|
| 21|      55.424297      57.063773|      -0.651014      -0.763945|       0.906958       0.895240|      54.833854      56.379859|
| 22|      61.359358      62.595955|      -0.868031      -0.801429|       0.931070       0.853896|      60.551161      61.911618|
| 23|      61.359358      62.595955|      -0.868031      -0.801429|       0.931070       0.853896|      60.551161      61.911618|
| 24|      63.852626      65.860980|      -1.394336      -1.675466|       0.752421       0.777855|      62.803499      64.557710|
| 25|      74.792892      76.102484|      -1.647301      -0.352389|       0.445529       0.133963|      74.058971      76.055277|
| 26|      78.120659      79.254778|      -1.759575      -2.110758|       0.536053       0.470714|      77.177433      78.261215|
| 27|      78.120659      79.254778|      -1.759575      -2.110758|       0.536053       0.470714|      77.177433      78.261215|
| 28|      82.790654      85.147738|      -3.946886      -4.263026|       0.052894       0.072255|      82.581888      84.839712|
| 29|      83.941022      85.838739|       7.807445       9.954354|       0.051558       0.031092|      84.343556      86.148238|
| 30|     108.218184     109.604526|      -5.782527      -6.953372|       0.059078       0.034490|     107.876565     109.364706|
| 31|     119.096413     120.342577|      -2.154810      -1.717329|       0.260205       0.219939|     118.535720     119.964869|
| 32|     119.411361     120.819509|      -0.921772      -0.917821|       0.479494       0.705129|     118.969377     120.172328|
| 33|     119.411361     120.819509|      -0.921772      -0.917821|       0.479494       0.705129|     118.969377     120.172328|
| 34|     122.845726     124.197045|      -0.817443      -0.900307|       0.905956       0.888350|     122.105159     123.397258|
| 35|     122.845726     124.197045|      -0.817443      -0.900307|       0.905956       0.888350|     122.105159     123.397258|
| 36|     136.603057     137.766615|      -1.071084      -0.964678|       0.839522       0.753581|     135.703858     137.039651|
| 37|     153.495675     154.488106|      -0.180590      -0.233172|       0.804014       0.783816|     153.350478     154.305343|
| 38|     153.495675     154.488106|      -0.180590      -0.233172|       0.804014       0.783816|     153.350478     154.305343|
| 39|     154.480866     155.523959|      -0.717886      -0.579153|       0.757432       0.540137|     153.937116     155.211137|
| 40|     154.480866     155.523959|      -0.717886      -0.579153|       0.757432       0.540137|     153.937116     155.211137|
| 41|     161.885430     162.794731|      -0.800889      -0.836388|       0.949608       0.946626|     161.124899     162.002984|
| 42|     161.885430     162.794731|      -0.800889      -0.836388|       0.949608       0.946626|     161.124899     162.002984|
| 43|     166.599613     167.494088|      -0.962363      -1.023529|       0.947624       0.939287|     165.687654     166.532700|
| 44|     166.599613     167.494088|      -0.962363      -1.023529|       0.947624       0.939287|     165.687654     166.532700|
| 45|     174.537580     175.798296|      -1.373349      -1.448812|       0.597400       0.455947|     173.717142     175.137715|
| 46|     180.125383     181.014108|      -7.800332      -8.345236|       0.045824       0.052813|     179.767943     180.573367|
| 47|     180.125383     181.014108|      -7.800332      -8.345236|       0.045824       0.052813|     179.767943     180.573367|
| 48|     213.068812     214.018330|       0.252687       0.365831|       0.542282       0.511046|     213.205839     214.205287|
| 49|     213.068812     214.018330|       0.252687       0.365831|       0.542282       0.511046|     213.205839     214.205287|
| 50|     219.270893     220.555064|      -1.938796      -2.960981|       0.176477       0.162501|     218.928740     220.073900|
| 51|     219.270893     220.555064|      -1.938796      -2.960981|       0.176477       0.162501|     218.928740     220.073900|
| 52|     223.583604     224.836971|      -2.166250      -2.308147|       0.827169       0.813326|     221.791749     222.959695|
| 53|     223.583604     224.836971|      -2.166250      -2.308147|       0.827169       0.813326|     221.791749     222.959695|
| 54|     225.673687     226.942111|      -1.940581      -2.032183|       0.718557       0.736592|     224.279268     225.445221|
| 55|     225.673687     226.942111|      -1.940581      -2.032183|       0.718557       0.736592|     224.279268     225.445221|
| 56|     232.988729     234.102959|      -1.881567      -2.045085|       0.839705       0.780821|     231.408767     232.506115|
| 57|     232.988729     234.102959|      -1.881567      -2.045085|       0.839705       0.780821|     231.408767     232.506115|
| 58|     235.127868     236.392790|      -1.479381      -1.530763|       0.852586       0.848586|     233.866567     235.093805|
| 59|     246.995097     248.258383|      -2.413365      -2.477425|       0.844987       0.827008|     244.955834     246.209533|
| 60|     252.143222     253.038330|       1.164816       1.274496|       0.076104       0.072370|     252.231868     253.130566|
| 61|     262.241873     263.508322|      -1.812946      -1.895509|       0.644388       0.629924|     261.073632     262.314296|
| 62|     262.241873     263.508322|      -1.812946      -1.895509|       0.644388       0.629924|     261.073632     262.314296|
| 63|     262.708705     264.007585|      -1.335318      -1.468419|       0.411017       0.422038|     262.159866     263.387856|
| 64|     264.467151     266.117634|      -2.391916      -2.598491|       0.692883       0.708662|     262.809834     264.276184|
| 65|     265.905622     267.144965|      -1.919437      -2.018551|       0.741188       0.716288|     264.482957     265.699101|
| 66|     265.905622     267.144965|      -1.919437      -2.018551|       0.741188       0.716288|     264.482957     265.699101|
| 67|     272.454491     274.024746|      -3.160663      -3.787646|       0.731495       0.407538|     270.142481     272.481136|
| 68|     298.025060     299.113789|      -3.619609      -7.920622|       0.026992       0.051544|     297.927359     298.705529|
| 69|     615.993161     616.361554|      -0.928705      -0.916285|       0.957699       0.926159|     615.103741     615.512929|
| 70|     659.510333     659.906468|      -1.667257      -1.689126|       0.478406       0.470252|     658.712707     659.112153|
 --------------------------------------------------------------------------------------------------------------------------------
         UG0W0 HOMO      energy:       0.000000 eV
         UG0W0 LUMO      energy:      -1.680575 eV
         UG0W0 HOMO-LUMO gap   :      -1.680575 eV
 --------------------------------------------------------------------------------------------------------------------------------
   RPA@UG0W0 total energy      :      -0.969843 au
   RPA@UG0W0 correlation energy:      -0.030694 au
    GM@UG0W0 total energy      :      -0.997531 au
    GM@UG0W0 correlation energy:      -0.058383 au
 --------------------------------------------------------------------------------------------------------------------------------


 -------------------------------------------------------------
   BSE@UGW  ��� calculation: spin-flip      manifold
 -------------------------------------------------------------
 | State |  Excitation energy (au) |  Excitation energy (eV) |
 -------------------------------------------------------------
 |     1 |               -0.129168 |               -3.514845 |
 |     2 |                0.025734 |                0.700268 |
 |     3 |                0.229369 |                6.241441 |
 |     4 |                0.312655 |                8.507770 |
 |     5 |                0.413746 |               11.258615 |
 |     6 |                0.428887 |               11.670610 |
 |     7 |                0.435723 |               11.856633 |
 |     8 |                0.435723 |               11.856633 |
 |     9 |                0.608114 |               16.547629 |
 |    10 |                0.626648 |               17.051960 |
 |    11 |                0.626648 |               17.051960 |
 |    12 |                0.655762 |               17.844201 |
 |    13 |                0.709461 |               19.305404 |
 |    14 |                0.767575 |               20.886780 |
 |    15 |                0.767575 |               20.886780 |
 |    16 |                0.900739 |               24.510354 |
 |    17 |                0.981629 |               26.711473 |
 |    18 |                0.981629 |               26.711473 |
 |    19 |                1.046149 |               28.467175 |
 |    20 |                1.137844 |               30.962312 |
 -------------------------------------------------------------

 -------------------------------------------------------------
 Excitation n.   1:  -3.514845 eV  f = 0.0000  <S**2> = 0.0191
 -------------------------------------------------------------
  1A ->   2B =  -0.148818
  1A ->   4B =   0.145437
  2A ->   1B =   0.947146
  2A ->   3B =  -0.234019

 -------------------------------------------------------------
 Excitation n.   2:   0.700268 eV  f = 0.0000  <S**2> = 1.9964
 -------------------------------------------------------------
  1A ->   1B =   0.679215
  1A ->   3B =  -0.216471
  2A ->   2B =  -0.585102
  2A ->   4B =   0.375188

 -------------------------------------------------------------
 Excitation n.   3:   6.241441 eV  f = 0.0000  <S**2> = 0.1744
 -------------------------------------------------------------
  1A ->   1B =  -0.619781
  1A ->   3B =   0.192636
  2A ->   2B =  -0.751305

 -------------------------------------------------------------
 Excitation n.   4:   8.507770 eV  f = 0.0000  <S**2> = 0.9708
 -------------------------------------------------------------
  1A ->   4B =   0.170514
  2A ->   1B =  -0.272917
  2A ->   3B =  -0.938654

 -------------------------------------------------------------
 Excitation n.   5:  11.258615 eV  f = 0.0000  <S**2> = 0.8770
 -------------------------------------------------------------
  1A ->   1B =   0.314964
  1A ->   3B =   0.188517
  2A ->   2B =  -0.284858
  2A ->   4B =  -0.877177

 -------------------------------------------------------------
 Excitation n.   6:  11.670610 eV  f = 0.0000  <S**2> = 0.1395
 -------------------------------------------------------------
  1A ->   2B =  -0.867796
  1A ->   4B =   0.349819
  2A ->   1B =  -0.161227
  2A ->   3B =   0.154151
  2A ->   7B =   0.267303

 -------------------------------------------------------------
 Excitation n.   7:  11.856633 eV  f = 0.0000  <S**2> = 1.0000
 -------------------------------------------------------------
  1A ->   8B =   0.129705
  2A ->   5B =  -0.989878

 -------------------------------------------------------------
 Excitation n.   8:  11.856633 eV  f = 0.0000  <S**2> = 1.0000
 -------------------------------------------------------------
  1A ->   9B =  -0.129705
  2A ->   6B =   0.989878

 -------------------------------------------------------------
 Excitation n.   9:  16.547629 eV  f = 0.0000  <S**2> = 0.9837
 -------------------------------------------------------------
  1A ->   1B =  -0.231889
  1A ->   3B =  -0.921988
  2A ->   4B =  -0.259774

 -------------------------------------------------------------
 Excitation n.  10:  17.051960 eV  f = 0.0000  <S**2> = 1.0000
 -------------------------------------------------------------
  1A ->   5B =   0.215025
  1A ->   6B =  -0.638064
  2A ->   8B =  -0.279121
  2A ->   9B =   0.680582

 -------------------------------------------------------------
 Excitation n.  11:  17.051960 eV  f = 0.0000  <S**2> = 1.0000
 -------------------------------------------------------------
  1A ->   5B =  -0.638064
  1A ->   6B =  -0.215025
  2A ->   8B =   0.680582
  2A ->   9B =   0.279121

 -------------------------------------------------------------
 Excitation n.  12:  17.844201 eV  f = 0.0000  <S**2> = 0.9543
 -------------------------------------------------------------
  1A ->   2B =   0.327579
  1A ->   4B =   0.111527
  2A ->   7B =   0.930938

 -------------------------------------------------------------
 Excitation n.  13:  19.305404 eV  f = 0.0000  <S**2> = 0.9293
 -------------------------------------------------------------
  1A ->   2B =  -0.338393
  1A ->   4B =  -0.885826
  2A ->   3B =  -0.176128
  2A ->   7B =   0.211950

 -------------------------------------------------------------
 Excitation n.  14:  20.886780 eV  f = 0.0000  <S**2> = 1.0000
 -------------------------------------------------------------
  1A ->   5B =  -0.731270
  2A ->   8B =  -0.674216

 -------------------------------------------------------------
 Excitation n.  15:  20.886780 eV  f = 0.0000  <S**2> = 1.0000
 -------------------------------------------------------------
  1A ->   6B =   0.731270
  2A ->   9B =   0.674216

 -------------------------------------------------------------
 Excitation n.  16:  24.510354 eV  f = 0.0000  <S**2> = 0.9792
 -------------------------------------------------------------
  1A ->   3B =   0.116631
  1A ->   7B =  -0.839920
  2A ->  10B =   0.518764

 -------------------------------------------------------------
 Excitation n.  17:  26.711473 eV  f = 0.0000  <S**2> = 1.0000
 -------------------------------------------------------------
  1A ->   8B =  -0.988525
  2A ->   5B =  -0.132230

 -------------------------------------------------------------
 Excitation n.  18:  26.711473 eV  f = 0.0000  <S**2> = 1.0000
 -------------------------------------------------------------
  1A ->   9B =  -0.988525
  2A ->   6B =  -0.132230

 -------------------------------------------------------------
 Excitation n.  19:  28.467175 eV  f = 0.0000  <S**2> = 0.9997
 -------------------------------------------------------------
  1A ->   7B =  -0.516224
  2A ->  10B =  -0.841828

 -------------------------------------------------------------
 Excitation n.  20:  30.962312 eV  f = 0.0000  <S**2> = 0.9951
 -------------------------------------------------------------
  1A ->   4B =  -0.112254
  1A ->  10B =   0.119753
  1A ->  12B =  -0.197144
  2A ->  11B =   0.960934

Thomas-Reiche-Kuhn sum rule =   0.000000


 -------------------------------------------------------------------------------
  Tr@BSE@UG0W0 correlation energy (spin-conserved) =        0.0000000000
  Tr@BSE@UG0W0 correlation energy (spin-flip)      =       -0.0000000000
  Tr@BSE@UG0W0 correlation energy                  =       -0.0000000000
  Tr@BSE@UG0W0 total energy                        =       -0.9391485307
 -------------------------------------------------------------------------------

                                       Total CPU time for G0W0 =      0.472 seconds

                                      Total CPU time for QuAcK =     18.052 seconds